CODE	Name	R1	R2	R3	R4	R5	R6	R7	R8	R9	R10	R11	R12	R13	R14	R15	R16	R17	R18	R19	R20	R21	R22	R23	R24	R25	R26	p.ttest	p.wilcox	EAS.score	EAS.class	KNN.score	KNN.class
C100005	1-Chloro-4-nitrobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.84609006367023	0.308248805441022	0.511098597753731		0.00362	
C100016	4-Nitroaniline	0	8.92e-05	0	0	0	0	0	0	0.000374	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.18	0	0.768028433281897	0.196221774481612	0.707252801173699		0	
C100027	4-Nitrophenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.52298805071757e-09	1.62022625355419e-11	10.790424334958		0	
C10016203	alpha-Cyclodextrin	0.000384	0.000579	0.286	0	0	0	0	0	0	0.0113	0.029	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00855800470606452	0.000417751555020259	3.37908192483263		0	
C100210	Terephthalic acid	0	0	0	0.000168	0	0	0	0	0	0	0	0	0	0	0	0.0843	0	0	0	0	0	0	0	0	0	0	4.18975802834171e-17	1.67695270906674e-20	19.7754791845501	EAS hi AUC low	0	
C10025748	Dysprosium(III) chloride	0	0	0	0	7.52e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0241	0	0	0	0	0	0	0.999999872096485	0.999995570850147	1.92355960035389e-06		NA	
C100378	N,N-Diethylethanolamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999998598158	0.999963464409702	1.58674951253828e-05		0	
C10042598	2-Propyl-1-heptanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.93746692255068e-05	7.14239314120257e-07	6.14615624846475		0.0021	
C10043353	Boric acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.569701492087128	0.0540394165206219	1.26728934882917		NA	
C100516	Benzyl alcohol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.52537808190269e-15	8.57949907400899e-18	17.0665380682987	EAS hi AUC low	0.00786	
C100549	3-Pyridinecarbonitrile	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.838124988166128	0.292235594249553	0.534266888180246		0	
C100641	Cyclohexanone oxime	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.576775380052043	0.421458028664042	0.375245668553349		NA	
C1007289	Deisopropylatrazine	0.00394	0	0.00192	0	0	0	0	0	0	0.458	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999998834608	0.999999999972439	1.19693771641443e-11		0.057	
C10081671	4-(2-Phenylpropan-2-yl)-N-[4-(2-phenylpropan-2-yl)phenyl]aniline	0	0	0	0	0	0	0	0	0.000799	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.129	0	6.37686699699586e-05	2.17711415738723e-05	4.66211879804962		0.00506	
C1008726	Sodium 2-formylbenzenesulfonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.57598012000443e-09	8.72077191826094e-10	9.05944507183304		0	
C10094345	1,1-Dimethyl-2-phenylethyl butanoate	0	0	0	0	0	0.000324	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0982	0	0	0	0	0	2.67261856890338e-10	8.35882596958005e-10	9.07785471666843		0	
C100970	Methenamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999989	0.999999999999999	5.78596479931973e-16		NA	
C101020	Triphenyl phosphite	0.0021	0	0	2.92e-06	0	0.064	0	0	0	0	0	0	0	0	0	0	0	0.0172	0	0	0.00493	0.000644	0	0	0	0	6.46328923868485e-12	1.75255387128712e-16	15.7563286234936	EAS hi AUC med	0.142	KNN hi AUC med
C101053	Anilazine	4.31e-05	0	0	0	0	0	0	0.478	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.987181967578874	0.67434322841447	0.1711189992139		NA	
C101100	Cloprop	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.64048346993952e-11	1.12626949909931e-11	10.9483576770092		0	
C101202	Triclocarban	0	0.000479	0	0	0	0	0	0	0.105	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.112	0	0.996570590899894	0.79504663500627	0.0996073962090949		0	
C101213	Chlorpropham	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999989357749348	0.997384940367024	0.00113719353180992		0	
C101371	2,4,6-Tris(allyloxy)-1,3,5-triazine	0	5.89e-07	0	0.0264	0	0	0	0	0	0	0	0	0	0	0	0.00435	0	0.0118	0	0	0	0	0	0	0	0	0.99999030790365	0.999792235316396	9.02404303356369e-05		NA	
C101428	Fenuron	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999998771293096	0.990374516017923	0.00420054329890155		0	
C101463698	Flufenoxuron	0	0	0	0	0	0	0	0	0.00143	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0629	4.77656281984717e-06	7.1939649209252e-05	4.14303168421083		0	
C101542	N-Phenyl-1,4-benzenediamine	0.000215	0	0	0	0	0.0918	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00244	0.00877	0	0	0	0	0.690281774294487	0.192259742954889	0.716111642661352		0.028	
C101553	p-Bromodiphenyl ether	0.00744	3.71e-07	0	0.000561	0	0.0495	0	0	0	0	0	0	0.00503	0	0.0108	0	0	0	0	0	0.00709	0.000937	0	0	0	0	4.69610403298739e-13	1.92054922352315e-15	14.7165745574233		0	
C101611	4,4'-Methylenebis(N,N-dimethylaniline)	0.0518	0	0	0	0	0	0	0.0526	0	0	0	0	0	0	0	0	0	0	0	0	0.00607	0	0	0	0	0	0.112333585496408	0.0311667876481143	1.50630795802448		0.00737	
C10161338	17beta-Trenbolone	0.475	0	0.000863	0	0	0	0	0.0415	0	0	0.0108	0	0	0	0	0	0	0	0	0	0	0	0	0.0017	0	0	2.17866569510247e-08	6.56020891028327e-12	11.1830823302678		0.524	
C101779	4,4'-Methylenedianiline	0.00885	0	0	0	0	0.0454	6.67e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00379	0.0046	0	0.00139	0	0	0.00131279327724177	2.15695786837669e-05	4.66615833784146		0.0458	
C101804	4,4'-Oxydianiline	0.00457	0	0	0	0	0.0979	0	0	0	0	0	0	0	0	0.00515	0	0	0	0	0	0.000898	0.00447	0	0	0	0	4.98129066041163e-08	8.22701942675295e-09	8.08475747717762		0.00848	
C101815	Diphenylmethane	0.0207	0	0	0	6.23e-07	0.00198	5.49e-06	0	0	0	0	0	0	0	0.000158	0	0	0	0	0	0	0	0	0.000787	0	0	1.6435932830362e-10	6.67453317624091e-16	15.1755791039068	EAS hi AUC med	0.383	KNN hi AUC med
C101837	Dicyclohexylamine	0	0	0	0	0	0.0787	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0332	0	0	0	0	0.999666086926448	0.999703321348381	0.000128865017991998		0	
C101848	Diphenyl oxide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.03749413664776e-12	2.75184017478287e-15	14.5603767932656		0.00744	
C101860	2-Benzylideneoctanal	0.00983	0	0	0	0	0.00618	3.56e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	1.93e-05	0.0485	0	0.0514	0	0	1.37241504295731e-12	1.48847012246554e-12	11.8272598783693		0.00842	
C102067	1,3-Diphenylguanidine	0	0.000156	0	0	0	0	0	0	0.000784	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.112	0.973071779306912	0.768831081564777	0.114169067744279		NA	
C10222012	2,2-Dibromo-3-nitrilopropionamide	0	0	0	0	0	0.0987	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0113	0	0	0	0	0	0.999999999967829	0.999999981396474	8.07940892855658e-09		NA	
C102272	N-Ethyl-3-methylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.423519925007262	0.21452726360175	0.668517506838777		0	
C1024573	Heptachlor epoxide	0.00739	0	0	0.0221	0	0.000168	0	0	0	0	0	0	0	0	0	0	0.00311	0	0	0	0.224	0	0	0	0	0	3.68864958590573e-12	1.36583234190297e-14	13.8646026077227		0.0181	
C102603	N,N,N',N'-Tetrakis(2-Hydroxypropyl)ethylenediamine	0	0	0	0	0	0	4.6e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.074	0	0	0.999999908141026	0.999645503937594	0.000153982978551987		0	
C10265926	Methamidophos	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999992905	0.999999999993008	3.03671540856025e-12		NA	
C102676313	Fadrozole hydrochloride	0.0825	0	0	0	0	0	0	0.116	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.444606331517221	0.065295236340887	1.18511850182341		NA	
C102716	Triethanolamine	0	0	0	0	0	7.86e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.149	0	0	0	0	0.999999999964165	0.999994720536374	2.292847972712e-06		0	
C102761	Triacetin	0.0182	0	0	0	0	0.0211	6.04e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00626	0	0	0.0501	0	0	0.999980813182349	0.972475931558916	0.0121211385066262		0	
C102829	Tributylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999998042909	0.999999980160021	8.61639348321923e-09		0	
C103055078	Lufenuron	0	0	0	0	0	0.000373	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.147	0	0	0	0	0.00014335990674638	0.00080523267140332	3.09407861241935		0	
C103093	2-Ethylhexyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.293758018044743	0.05849851961193	1.23285512421705		0	
C1031078	Endosulfan sulfate	0	0.00235	0	0	0	0.000701	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.117	0	0	0	0.0334	4.73103421835727e-09	4.03972387792162e-10	9.39364831865008		0.0619	
C103117	2-Ethylhexyl acrylate	0	2.16e-05	0	0	0.00329	0	0	0	0	0	0	0	0	0	0	0	0	0	0.197	0	0	0	0	0	0	0	0.0978752481480617	0.0237448160060951	1.62443119133137		0	
C103231	Di(2-ethylhexyl) adipate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.289649925972547	0.0501536896657956	1.29969711164553		0	
C103242	Bis(2-ethylhexyl) nonanedioate	0	0	0	0	0	5.4e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0392	0	0	0	0	0.106585715768187	0.0107653259899484	1.96797281456393		0	
C103333	Azobenzene	0	0	0	0	0	1.73e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0381	0	0	0	0	0.383218737786402	0.110984230630809	0.954738724245262		0.0658	
C103344	4,4'-Dithiodimorpholine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0177	0	0	0	0	0	1	1	0		0	
C103361097	Flumioxazin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0333213258211411	0.0283735981172005	1.54708558689149		NA	
C1034011	Octyl gallate	0.0144	0.0768	2.92e-06	0	0	0.000869	0	0	0	0	0	0.0244	0	0	3.66e-05	0	0	0	0.00745	0	0.0235	0	0	0	0	0	8.77215324128351e-12	5.65663039457273e-15	14.2474421972259		0.269	KNN hi AUC med
C103413	Benzyl cinnamate	0	0	0	0	0	0	0.000256	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.119	0	0	1.56102793179321e-08	1.95681923452119e-09	8.70844929139663		0.00188	
C103651	Propylbenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.05523461560299e-11	3.89640064098063e-15	14.4093363938824		0	
C103695	N-Ethylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.974384733616292	0.893153645381422	0.0490738248722783		0.00816	
C103764	1-Piperazineethanol	0	0	0	0	4.91e-08	0	0	0	0	0	0	0	0	0	0	0	0	0	0.146	0	0	0	0	0	0	0	0.999999999331334	0.99999976530275	1.01927732395327e-07		0.0078	
C103902	Acetaminophen	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.33253411743041e-07	3.21679519421667e-07	6.49257658872594		NA	
C104098488	Imazapic	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.17923998514545	0.0501128204477131	1.30005115362536		0	
C104132	4-Butylaniline	0.00355	0	0	0	0	0.0769	0	0	0	0	0	0	0	0	0.000479	0	0	0	0	0	0.0283	0	0	0	0	0	0.000393701613981703	0.000122364027969875	3.91234623537894		0.0138	
C104206828	Mesotrione	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.32395559859629e-05	0.000936883462224094	3.0283144271065		NA	
C104405	4-Nonylphenol	0.088	0	0	0	0	0.064	7.82e-06	0	0	0	0	0	0	0	0	9.39e-06	0	2.08e-05	0	0	0.00725	0.00445	0	0.00175	0	0	1.08310250654898e-15	3.12527712239893e-25	24.5051114671543	EAS hi AUC med	0.41	KNN hi AUC med
C104438	4-Dodecylphenol	0.41	0	0	6.02e-06	0.000105	0.0385	0	0.00127	0	0	0	0	0	0	0	0	5.04e-05	0	0.000131	0	0.00298	0.00648	0	0.000522	0	0	8.59248549480366e-16	1.03186477239053e-24	23.9863772140002		0.392	
C104450	4-Propylanisole	0	0	0	0	0	0	0.000527	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0671	0	0	9.18539838945277e-16	2.76447133369104e-20	19.5583879091379	EAS hi AUC low	0.111	KNN hi AUC low
C104518	Butylbenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.17197958031419e-11	2.44647679742391e-14	13.6114588987671		0	
C10453868	Resmethrin	0.00944	0	0	0	0	0	2.23e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0227	0	0	0.00832	0.0301	0	2.31956736361841e-12	3.8346946127878e-12	11.4162692166595		0	
C104541	3-Phenyl-2-propen-1-ol	0.00786	0	0	0	0	0.0675	0.000141	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000429	0.00469	0	0.0112	0	0	3.04898846391514e-13	4.58299685436255e-15	14.3388504408424		0	
C104610	gamma-Nonanolactone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.148049696092387	0.0188932613018826	1.7236930689093		0	
C104665	1,2-Diphenoxyethane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.89157652026339e-10	1.79715658400551e-11	10.7454140817074		0	
C104676	5-Heptyldihydro-2(3H)-furanone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.146177966502762	0.0182101677840132	1.73968605270396		0	
C104767	2-Ethyl-1-hexanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000941316730065955	2.35444279437762e-05	4.62811185709552		0.0021	
C104795688	CI-959	0	0	0	0	0	0.0453	0	0	0.0385	0	0	0	0	0	0	0	0	0	0	0	2.01e-07	0.00256	0	0	0	0.0473	1.27231565897984e-05	0.000181121466492888	3.74203007410937		NA	
C105215	1,4-Heptanolide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.239477538077223	0.0389811790745071	1.40914502879439		0	
C105373	Ethyl propionate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999918362831862	0.982446095995771	0.00769126879355668		0.00416	
C10540291	Tamoxifen	0.0199	0.447	0.00803	0.0683	0	0	0	0	0	0	0.00177	0	0	0.00201	0.0236	0.01	0.00128	0.0712	0	0	0	0	0	0	0	0	2.16986636689275e-13	1.98375054546641e-14	13.7025129408203		0.0118	
C105512069	Clodinafop-propargyl mixt.	0	0.000117	0	0	0	0	0	0	0.00132	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.24	0	0.139953445442978	0.0640724160719045	1.19332889912485		0.0272	
C105533	Diethyl propanedioate	0.00416	0	0	0	0	3.12e-06	9.54e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0484	0	0.00961	0	0	0.999886176493633	0.972358802809301	0.0121734497583664		0	
C105544	Ethyl butyrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99694181814092	0.872919825613776	0.0590256427692164		0	
C105555	N,N'-Diethylthiourea	0.0196	0	0.000302	0	0	0	0	0	0	0	0	0.114	0	0	0	0	0	0	0	0	0	0	0	0.0304	0	0	0.999999999999871	0.999999999999999	3.37514613293651e-16		0	
C105602	Caprolactam	0	0	0	0	0	0.00033	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.094	0	0	0	0	0	0.999963312801245	0.999720049620787	0.000121597926385962		NA	
C105624860	5HPP-33	0.418	0	0.000496	0	0	0.000154	0.000638	0.000488	0	0	1.26e-05	0.00401	0	0	0	0	3.69e-05	0	0.000318	0	0.00991	0	0	0.0365	0	0	9.67720501363416e-13	9.99289926111671e-10	9.00030849071001		NA	
C105679	2,4-Dimethylphenol	0	0	0	0	0	1.15e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0305	0	0	0	0	0	1.74748348595937e-18	1.03481080785769e-24	23.985139044037	EAS hi AUC low	0.00488	
C105873	Geranyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.801607430258377	0.422129286720021	0.374554516076644		0	
C105997	Dibutyl hexanedioate	0	0	0	0	0	3.3e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0905	0	0	0	0	0.824136933587817	0.361677731075455	0.441678230438761		0	
C10605217	Carbendazim	0	0	0	0	0	0	0.000427	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0521	0	0	0.999999998766542	0.998953906723129	0.000454550330196548		0	
C1061517621	PharmaGSID_47337	0	8.24e-05	0	0	0	0	0	0	0.000749	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.139	0	0.156979910703746	0.0379460965411702	1.42083289270186		NA	
C106229	Citronellol	0	0	0	0	0	0.026	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0551	0	0	0	0	0	0.000129425412671838	8.11370463418685e-06	5.09078080610638		0	
C106230	Citronellal	0	4.84e-06	0	0	0.000372	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0867	0	0	0	0	0	0	0	0.00317273622415527	0.000505126298003365	3.29660002055825		0	
C106241	Geraniol	0	0	0	0	0	0.00126	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0354	0	0	0	0	0	0.00664300190206627	0.000392388369187571	3.4062838740559		0.0162	
C106252	(2Z)-3,7-Dimethylocta-2,6-dien-1-ol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00664300190206627	0.000392388369187571	3.4062838740559		0.0162	
C106274	Isopentyl butyrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.958806406525183	0.658534418902032	0.181421521311787		0	
C106309	Ethyl heptanoate	0.0173	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00843	0	0	0.00316	0	0	0.610733988027902	0.156404373373618	0.805751107379273		0	
C106434	4-Chlorotoluene	0	0	0	0	0	1.75e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.261	0	0	0	0	1.416134974943e-07	3.16210630024463e-11	10.5000235345197		0.0677	
C106445	p-Cresol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.52599075808403e-16	8.50647291436074e-24	23.0702504765023	EAS hi AUC low	0.319	KNN hi AUC low
C106456	4-Thiocresol	0	0	0	0	0	0.000242	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.124	0	0	0	0	0	1.39109268240419e-10	2.0956445636653e-13	12.6786823748986		NA	
C106467	1,4-Dichlorobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.083739190725e-05	2.46228478825162e-08	7.60866171793054		0.00153	
C106478	4-Chloroaniline	0	1.73e-07	0	0	0	0	0	0	0.0014	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.193	0	0.400459471049099	0.081438090508501	1.0891724178578		0.0201	
C106489	4-Chlorophenol	0.0293	0.00838	0	0	0	0	0	0	0	0	0.0949	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.41573062854342e-14	2.80702945611725e-19	18.5517530299868	EAS hi AUC med	0.00424	
C106490	4-Methylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.015286539066892	0.000395584573688886	3.40276065259665		0.0183	
C106503	1,4-Benzenediamine	0.0201	0.0158	0	0.00464	0.00643	0	0	0	0	0	0	0	0	0	0	0.00379	0	0.0424	0	0	0	0	0	0	0	0	0.297809342010781	0.0296785032019991	1.52755800593696		0.0658	
C106650	Dimethyl succinate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.997781917023564	0.907350398439638	0.0422249657276518		0	
C106683	3-Octanone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0746904322099678	0.0165502957732363	1.78119424046611		0.0319	
C1067250	Trimethoxypropylsilane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999992554387233	0.972871766949646	0.0119443997894906		NA	
C1067534	Tris(2-methoxyethoxy)vinylsilane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999995560607	0.996792249637369	0.00139534744334151		NA	
C106876	4-Vinyl-1-cyclohexene dioxide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.67694480856246e-09	6.24467168016687e-10	9.20449039015455		NA	
C1068967963	SAR102608	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.971065412990469	0.338275545185489	0.470729397349128		NA	
C106934	1,2-Dibromoethane	7.37e-05	0	0	0	0	0.0653	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0086	0.00332	0	0	0	0	0.999999999909107	0.998292781164879	0.000742069337259041		NA	
C107073	2-Chloroethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99395790794848	0.112489211940692	0.948889125724023		NA	
C107131	Acrylonitrile	0	0	0	0	0	2.14e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0548	0	0	0	0	0.999988488685624	0.999998697780706	5.65547021969452e-07		NA	
C107186	Allyl alcohol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.666354468177825	0.0116702818738922	1.93291865425475		NA	
C107200	Chloroacetaldehyde	0	0	0	0	0	0	0.000458	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0801	0	0	0.999997233746186	0.998531179668781	0.000638369504663484		NA	
C107211	Ethylene glycol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999395576236993	0.139452625638812	0.855573304347287		NA	
C1072157	Sulfuric acid, monononyl ester, sodium salt	0.093	0	1.94e-05	0	0	0.0167	0	0	0	0	0.0128	0	0	0	0	0	0	0	0	0	0.00902	0.00901	0	0.0029	0	0	0.580609832236763	0.156183192108603	0.806365705204234		0.00252	
C107302	Chloromethyl methyl ether	0.0306	0	0	0	0	0	0	0.331	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999780541	0.999838998112954	6.99278605297306e-05		NA	
C107415	2-Methyl-2,4-pentanediol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000415649619704546	7.47561004438488e-06	5.12635336111729		0	
C107460	Hexamethyldisiloxane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999997024	0.999999616517955	1.66544168037391e-07		0	
C107517	Octamethyltrisiloxane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999996334	0.999999616772876	1.66433457174742e-07		0	
C107534963	Tebuconazole	0	0	0	7.47e-05	0	0	0	0	0	0	0	0	0	0	0	0	0.0645	0	0	0	0	0	0	0	0	0	1.19958080851794e-10	2.43626580416782e-11	10.613275330577		0.0268	
C107540	3,5-Dimethyl-1-hexyn-3-ol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00028629733455395	1.23860396854132e-05	4.90706753282569		0	
C1076977	1,4-Cyclohexanedicarboxylic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.38020336193524e-06	1.28674419204619e-07	6.89050778334046		0	
C107755	7-Hydroxy-3,7-dimethyloctanal	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.69976230151228e-06	5.68940201164903e-08	7.24493337801419		0	
C107879	2-Pentanone	0.00202	0.0065	0	1e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.033	0	0.055	0	0	0	0	0	0	0.68221162598771	0.369807902114432	0.432023813003707		0	
C107880	1,3-Butanediol	0.000104	0	0	0	0	0.101	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000571	0.00373	0	0	0	0	0.64883866977866	0.0296341669159507	1.52820727726219		0	
C107926	Butanoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.681618476529825	0.237035154583293	0.625187239182606		0	
C107982	1-Methoxy-2-propanol	0.0156	3.38e-05	0.0784	0	0	0	0	0	0	0.00293	0.0206	0	0	0	0	0	0	0	0	0	0	0	0	0.000139	0	0	0.997846013122977	0.48228115619022	0.316699706609078		0	
C108010	Dimethylaminoethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999997754	0.999997924725453	9.01281219297397e-07		NA	
C108112	4-Methyl-2-pentanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00420225761540604	9.31062316693629e-05	4.03102125039304		0.00239	
C108214	Isopropyl acetate	0.0152	0.000759	0	0.000597	0	0	1.17e-07	0	0	0	0	0	0	0	0	0.00115	0	0.0256	0	0.0357	0	0	0	0.0116	0	0	0.999919149489583	0.9743809155745	0.0112712308091597		0	
C108327	Propylene carbonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999922693378501	0.9785959696358	0.00939657722163209		0	
C108383	1,3-Dimethylbenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.30516188233046e-10	2.22157164870426e-15	14.6533396756101		0	
C108394	m-Cresol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.12487433679992e-17	5.08209982119383e-23	22.2939568089102	EAS hi AUC low	0.00783	
C108419336	Acetic acid, C8-10-branched alkyl esters, C9-rich	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.334345532662904	0.0782076967098664	1.10675050430412		0	
C108441	3-Methylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0271440809391359	0.00111326957148345	2.9533996611529		0	
C108452	1,3-Benzenediamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.434409534461738	0.0925182411412307	1.03377263216946		0.0201	
C108463	Resorcinol	0.00321	0.0101	0	0.0063	0	0	0	0	0	0	0	0	0	0	0	0.00196	0	0.0341	0	0.0347	0	0	0	0	0	0	3.00786510931135e-15	1.43093046711302e-19	18.844381469303	EAS hi AUC med	0	
C1085127	Heptylparaben	0.269	0	0.00424	0	0	0	0	0.00468	0	0	0.00302	0	0	0	4.04e-05	0	0.000708	0	0	0	0	0.000394	0	0	0	0	6.4490977798366e-11	1.02002618087826e-14	13.9913886811155		0.37	
C108598	Dimethyl malonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99993887660049	0.98249182097747	0.00767105634097078		0.00416	
C108678	1,3,5-Trimethylbenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.87888206248762e-11	1.6840733081788e-15	14.7736390074655		0	
C108689	3,5-Dimethylphenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.96706242572326e-18	4.49993313153045e-24	23.3467939397409	EAS hi AUC low	0	
C108770	2,4,6-Trichloro-s-triazine	0.00306	0	0	3.46e-06	0	0	4.86e-06	0	0	0	0	0	0	0	0	0	0	0.0021	0	0	0	0	0	0.0622	0	0	0.99999225348021	0.999190247610678	0.000351813454514842		NA	
C108805	Cyanuric acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.997568898992946	0.959664548474508	0.0178805484246105		0	
C108838	Diisobutyl ketone	0	4.16e-05	0	0.013	0	0	0	0	0	0	0	0	0	0	0	0.00573	0	0	0	0	0	0	0	0	0	0	0.00565181580199905	0.00118282423984184	2.9270797839754		0	
C108918	Cyclohexylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.986512744245693	0.99223546346006	0.00338525491545896		0	
C108930	Cyclohexanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.69468253238088e-05	4.17367205953189e-07	6.37948167801395		0.0253	
C108941	Cyclohexanone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00536437214417151	0.000860401108466904	3.0652990387765		0	
C108952	Phenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.17740425980127e-14	1.2159158053344e-19	18.9150964962348	EAS hi AUC low	0.0155	
C108985	Benzenethiol	0.00908	0	0	0	0	0.0234	3.39e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0153	0	0	0.0076	0	0	4.41880214361099e-06	5.65269098347746e-09	8.24774475553382		NA	
C109024	4-Methylmorpholine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999951	2.13116370108282e-14		0	
C109433	Dibutyl decanedioate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.421083369188428	0.0777459980269525	1.10932195702194		0.0173	
C109466	N,N'-Dibutylthiourea	0	0	0	2.24e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0431	0	0	0	0	0	0	0	0	0.999999914124379	0.99999999891306	4.72052085017152e-10		0.0196	
C109524	Pentanoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.359690000613761	0.0769239358169869	1.1139385031664		0	
C109557	3-(Dimethylamino)propylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999318597	0.99999999994918	2.20710448912992e-11		0.00669	
C1095905	Methadone hydrochloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.27269772156324e-11	6.90787985083034e-09	8.16065522474893		NA	
C109773	Propanedinitrile	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999935516	0.999999992073787	3.44231049386397e-09		NA	
C109864	2-Methoxyethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999970646931971	0.670556528980303	0.173564604554556		0	
C110054	Di-tert-butyl peroxide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.418938755352469	0.170840801134371	0.767408400676374		NA	
C110123	5-Methyl-2-hexanone	0	0	0	0.00638	0	0	0	0	0	0	0	0	0	0.0153	0	0	0	0.018	0	0	0	0	0	0	0	0	0.0504475580419772	0.0185849527868002	1.73083853784822		0	
C110156	Butanedioic acid	0	0	0	0	0	0	0.000379	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0646	0	0	0.702236218016329	0.231932960093957	0.634637529198285		0	
C110167	Maleic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.120061663287969	0.0293380194440469	1.53256920792812		0	
C110178	Fumaric acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.120061663287969	0.0293380194440469	1.53256920792812		0	
C110235477	Mepanipyrim	7.79e-05	0	0	0	0	0	0.00155	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.147	0	0	0.996908521008041	0.714161016906271	0.146203859834302		0.0356	
C110258	Oleyl sarcosine	0	0.018	0	0	3.36e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0272	0	0	0	0	0	0.00516	0	0.952351788812115	0.89558690505007	0.0478922651444502		0	
C110269	N,N'-Methylenebisacrylamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999672	0.999999999991405	3.73262232480385e-12		NA	
C110270	Isopropyl tetradecanoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.288398239419489	0.0386594194457225	1.41274467212361		0	
C110338	Dihexyl hexanedioate	0	0	0	0	0	2.81e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0988	0	0	0	0	0.784737156174093	0.324350686344958	0.488985178740345		0	
C110429	Methyl decanoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.303762754009822	0.0466673330398534	1.33098701761003		0	
C110430	2-Heptanone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.173819845202136	0.0516440959141841	1.28697932096823		0.00202	
C110441	Sorbic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0644907982975731	0.0124566516992674	1.90459867870006		0	
C110488705	Dimethomorph	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.12399484141663e-08	7.07667176315803e-07	6.1501709477825		NA	
C110623	Pentanal	0	0	0	0	0	3.3e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0618	0	0	0	0	0	0.910720318784153	0.505684275351408	0.296120550884542		0.0319	
C110634	1,4-Butanediol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.862229133739241	0.0661151896194845	1.17969875216217		NA	
C110656	2-Butyne-1,4-diol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.958140863048289	0.0516578610873025	1.28686357991285		NA	
C110690	Butanal oxime	0	0	0	0	0	0.00031	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0857	0	0	0	0	0.997624279280806	0.984619589467385	0.00673152798540751		0	
C110736	2-(Ethylamino)ethanol	0	0	0	0	0	0	0.00145	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0726	0	0	0.999999947174611	0.999857577768029	6.18575944983635e-05		0	
C110805	2-Ethoxyethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999687823293736	0.546684502197956	0.262263237623553		0	
C110850	Piperazine	0	0	0	0	0	0	0.000343	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0997	0	0	0.999999999334631	0.99999999998891	4.81642996447376e-12		0	
C110872	3,4-Dihydro-2H-pyran	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.533672470120572	0.107772305000759	0.96749282848737		NA	
C110918	Morpholine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999994263	0.999999999999776	9.72524250019099e-14		NA	
C110974	Diisopropanolamine	0.0651	0	0	0.000512	0	0	0	0.0415	0	0	0	0	0	0.000478	0	0.00298	0	0.000295	0	0	0	0	0	0	0	0	0.999999244879084	0.998769273419766	0.000534826942944028		0	
C11099073	Glyceryl stearates	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.214073216299751	0.031912298282436	1.49604191735344		0	
C111115	Methyl octanoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.303593829370949	0.0470549159914326	1.32739499760498		0	
C111148	Heptanoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0436459758009699	0.00266996903764701	2.57349377491146		0.00457	
C111159	2-Ethoxyethyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999995897454093	0.993521888202914	0.00282256054104948		0	
C1111780	Ammonium carbamate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999989	4.86985370609413e-15		NA	
C111206	Decanedioic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0176971029263517	0.000392390494361023	3.40628152192552		0.00457	
C111217	Triethylene glycol diacetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999995109289408	0.992468860424385	0.00328311071901927		0	
C1112396	Dimethoxydimethylsilane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999998823409	0.999782070149733	9.46560459765086e-05		0	
C111273	1-Hexanol	0	0	0	0	0	0	1.74e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0558	0	0	0.179181420360519	0.00778435893363502	2.1087771471355		0	
C111308	Glutaraldehyde	0	0	0	2.21e-06	0	0	0	0	0	0	0	0	0	0	0	0.0317	0	0	0	0	0	0	0	0	0	0	0.965036392056142	0.619527276835012	0.207939567547577		0	
C111400	Diethylenetriamine	0	6.03e-07	0	0	0.000546	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0987	0	0	0	0	0	0	0	0.999999999875167	0.999999999999547	1.96915668670226e-13		0	
C111422	Diethanolamine	0	0	0	0.00123	0	0	0	0	0	0	0	0	0	0.144	0	0	0	0	0	0	0	0	0	0	0	0	0.999999996929071	0.99998287896718	7.43563373107827e-06		0	
C111444	Bis(2-chloroethyl) ether	0	0	0	0	0	0.00272	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.271	0	0	0	0	0.999999750829716	0.985018344584042	0.00655568130194658		0	
C111466	Diethylene glycol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999945331681863	0.525194892547233	0.279679506019989		0	
C1114712	Pebulate	0.00391	4.55e-05	0.00167	0	0	0	0	0	0	0	0.192	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999994	0.999999999881467	5.14782109863318e-11		0	
C111499	Hexamethyleneimine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999983669656501	0.999999925210273	3.24807668430268e-08		NA	
C111557	1,2-Ethanediol diacetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999997378132905	0.995184484639529	0.00209640344100077		0	
C111626	Ethyl oleate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.216503037104293	0.0302757874385126	1.51890455253657		0.0173	
C111693	Hexanedinitrile	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999559147191533	0.987649476831818	0.005397161979456		NA	
C111706	1-Heptanol	0	0	0	0	0	0.11	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.64e-07	0.0191	0	0	0	0	0.0522877066244719	0.00118749810934069	2.92536707315872		0.00481	
C111717	Heptanal	0.0319	0	0	0	0	0.00238	0	0	0	0	0	0	0	0	0	0.000717	0	0.000161	0	0	0.00504	0	0	0	0	0	0.307660836837446	0.0598606996479214	1.22285821146082		0.0879	
C111762	2-Butoxyethanol	0	0	0	0	0	1.83e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0111	0	0	0	0	0.969871508567651	0.318866354368645	0.496391303531952		0	
C111773	Diethylene glycol monomethyl ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999883843777029	0.621234595311102	0.206744367279667		0	
C111812589	Fenpyroximate (Z,E)	0	0	0	0	0	0	0	0.214	0.0388	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0801	4.9752874437897e-05	0.00031115704609356	3.50702036005022		NA	
C111820	Methyl dodecanoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.303762754009822	0.0466673330398534	1.33098701761003		0	
C111842	Nonane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0265	0	0	0	0	0.228578900361412	0.00936329729879869	2.02857118689185		0	
C1118463	Butyltin trichloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999770281322894	0.944357308047392	0.0248636544803559		0	
C111875	1-Octanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0232132941280827	0.000330728057969953	3.48052895929064		0.00481	
C1118929	N,N-Dimethyloctanamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99475583928234	0.977986561094683	0.00966711298593862		NA	
C111900	2-(2-Ethoxyethoxy)ethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999447445136195	0.521254044156525	0.282950562525525		0	
C1119400	Dimethyl glutarate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.925795879460975	0.57683789348115	0.238946217794159		0	
C111966	Bis(2-methoxyethyl) ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999997605291	0.985315194848217	0.0064248197700504		0	
C111988499	Thiacloprid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999996130640169	0.990367718660869	0.0042035240549117		0	
C111991094	Nicosulfuron	0	0	0	0	0	0.0558	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0199	0	0	0	0	0	0.997715858352211	0.731487288984971	0.135793216184807		NA	
C1120010	Sodium hexyldecyl sulfate	0	0	0.00022	0	0	0	0	0	0	0	0	0.121	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.555499952708138	0.15311952375881	0.814969430332922		0.093	
C1120043	Octadecyl sulfate sodium salt	0.00252	0.0108	0	0.00794	0	0	0	0	0	0	0	0	0	0	0	0.00521	0	0.0168	0	0	0	0.00751	0	0	0.0248	0	0.580609832236763	0.156183192108603	0.806365705204234		0.093	
C112005	Dodecyltrimethylammonium chloride	0.000105	0	0	0	0	0	0	0.147	0.021	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.55e-05	0.998985438779918	0.998993886123072	0.000437169663044767		0.0071	
C1120214	Undecane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.228578900361412	0.00936329729879869	2.02857118689185		0	
C112050	Nonanoic acid	0	0	0	0	0	4.18e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0225	0	0	0	0	0.0238213057034656	0.000903548162824852	3.044048692808		0.248	KNN hi AUC low
C1120714	1,3-Propane sultone	0	0	0	0.000199	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0868	0	0	0	0	0	0	0	0	0.999999903154602	0.999560820891704	0.000190774958555197		NA	
C112072	2-Butoxyethyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998814876856531	0.926150602133922	0.0333183865819959		0	
C112129	2-Undecanone	0.00139	0	0	2.23e-06	0	0	0	0	0	0	0	0	0.0282	0	0	0	0	0	0	0	0	0.00464	0	0	0	0	0.0570983715265278	0.0109759077107818	1.95955955331979		0	
C112141	Octyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.540103568199028	0.137442292000665	0.861879611116575		0	
C112185	N,N-Dimethyldodecan-1-amine	0	0	0	0.0165	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99796830507486	0.998488915800214	0.000656751858398342		0.0071	
C112226616	Halofenozide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0749225721418752	0.0580836885036669	1.23594581231614		0	
C112254	2-(Hexyloxy)ethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.550096803675875	0.0694675973855034	1.15821772142595		0	
C112276	Triethylene glycol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999945076400204	0.525562576152836	0.279375567247677		0	
C112281773	Tetraconazole	0	0.0127	0	0	0	0	0	0	0.0333	0	0	0	0	0	0	0	0	0	0	0	0.0252	0	0	0	0	0.0509	0.00121855136346517	0.00192698204343053	2.71512233229596		0	
C112301	1-Decanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0232132941280827	0.000330728057969953	3.48052895929064		0.00481	
C112312	Decanal	0	6.55e-05	0	0	0	0	0	0	0.000852	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.073	0	0.129300189064397	0.016577487777364	1.78048128362258		0.0879	
C112345	2-(2-Butoxyethoxy)ethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.970008132868645	0.320517011593994	0.49414891514568		0	
C112356	2-[2-(2-Methoxyethoxy)ethoxy]ethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999883843777029	0.621234595311102	0.206744367279667		0	
C112389	10-Undecenoic acid	0	0	0	0	0	0	0	0	0.00037	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0746	0	0.00248920109034876	5.7343923047369e-05	4.24151259915472		0.00166	
C112410238	Tebufenozide	0	0	0	0	0	0	0	0	1.59e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0592	0	0.000560998593194816	0.00247970561965644	2.60559987374929		0	
C112425	1-Undecanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0232132941280827	0.000330728057969953	3.48052895929064		0.00481	
C112492	Triethylene glycol dimethyl ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999997605291	0.985315194848217	0.0064248197700504		0	
C112505	2-[2-(2-Ethoxyethoxy)ethoxy]ethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999447445136195	0.521254044156525	0.282950562525525		0	
C112529154	Pioglitazone hydrochloride	0.00454	0	0	0.0107	0	7.72e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.142	0	0	0	0	0.00027838422605466	0.000694197411915441	3.15851700978437		NA	
C112538	1-Dodecanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0232132941280827	0.000330728057969953	3.48052895929064		0.00481	
C112550	1-Dodecanethiol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.372061834581442	0.0781304619261634	1.10717960802895		0	
C112607	Tetraethylene glycol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999945076400204	0.525562576152836	0.279375567247677		0	
C112630	Methyl linoleate	0	0	0	0	0	0	0	0	0.00122	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0946	0	0.120067332464306	0.0155240753178008	1.80899425887032		0	
C112709	1-Tridecanol	0.00481	0	0	0	0	0	3.65e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.013	0	0	0.00714	0	0	0.0261806306313829	0.000348877468636662	3.45732707744996		0	
C112721	1-Tetradecanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0232132941280827	0.000330728057969953	3.48052895929064		0.00481	
C112733069	Zenarestat	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.666307920073148	0.126039217901926	0.899494300372139		NA	
C112801	Oleic acid	0	4.05e-06	0.000541	0	0	0	0	0	0	0	0	0.0888	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00441189518767345	0.000144181504245518	3.84109044779484		0.00166	
C112809515	Letrozole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0685025743513577	0.0545116922785822	1.26351033538485		NA	
C113136779	Cyclanilide	0	5.23e-05	0	0	0	0	0	0	0.00147	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0987	0	0.592997989188654	0.514418550325946	0.288683378810631		NA	
C1134232	Cycloate	0	0	0	0	0	0.0455	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00624	0.0805	0	0	0	0	0.99999999999972	0.999999987882842	5.2624148149619e-09		0	
C113484	MGK-264	0	0	0	0	0	0.000122	0	0	0.000184	0	0	0	0	0	0	0	0	0	0	0	0.0398	0	0	0	0.0234	0	0.499006747066927	0.419652719142964	0.377109958527383		NA	
C113734182	CP-114271	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.40210721454755e-07	4.68958599681514e-07	6.32886549571453		NA	
C114078	Erythromycin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0214824824304874	0.0225877941450411	1.64612617888097		NA	
C114261	Propoxur	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.49157383002849e-07	9.34817807038278e-07	6.02927302346765		0	
C114311329	Imazamox	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.413452095088363	0.114723762851783	0.940346616915419		0	
C1143380	Anthralin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.04537999273642e-21	3.48721387069565e-25	24.457521416543	EAS hi AUC low	0.397	KNN hi AUC low
C114369436	Fenbuconazole	0.000538	0	0	0	0	0	0	0.383	0.0528	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000544408939638665	0.000589345867913812	3.22962975709479		0	
C115286	Chlorendic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.74856049356678e-09	7.02255805509374e-10	9.15350466182341		NA	
C115297	Endosulfan	0.0295	0	0	0	0	0.0739	0.000175	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00596	0.00375	0	0.0279	0	0.000378	5.59511053327395e-09	3.42337496629117e-10	9.46554552947081		0.0619	
C115322	Dicofol	0	0.0229	0	0.0272	0	0	0	0	0.0125	0	0	0	0	0	0.00136	0.0178	0.00219	0.00209	0	0	0	0	0	0	0	0	1.19540009892887e-16	5.4377580712082e-22	21.2645801183146	EAS hi AUC low	NA	
C115399	Bromophenol blue	0	0.0128	0	0	0	0	0	0	0.000244	0	0	0	0	0	1.74e-05	0	0	0	0	0	0	0	0	0	0	0.184	5.3324961201899e-19	1.33972777989477e-22	21.872983437232	EAS hi AUC low	0.0409	
C1156190	Tolazamide	1.67e-05	0	0	0	0	0	0.000763	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0967	0	0	0.968927600690321	0.553121256535632	0.257179651205864		NA	
C115775	Pentaerythritol	0	1.77e-06	0.00251	0	0	0	0	0	0	0	0.267	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.235486086127137	0.000536272305520599	3.27061463054046		0	
C115866	Triphenyl phosphate	0.0641	0.0314	0	0.000945	0	7.82e-06	0	0	0	0	0	0	8.31e-05	0	0.00195	0.000691	0	0	0.00773	0	0	0.0115	0	0.00212	0	0	7.8216835595372e-12	1.14635349834608e-16	15.9406814393425	EAS hi AUC med	0.142	KNN hi AUC med
C115957	Linalyl acetate	0	0.000101	0.142	0	0	0	0	0	0	0.00338	0.0223	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0996407121174187	0.026273002056762	1.58049030017945		NA	
C115968	Tris(2-chloroethyl) phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999997517041541	0.999184530150816	0.000354298535187508		0	
C116029	3,3,5-Trimethylcyclohexanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.1157389549858e-09	2.76700688923598e-13	12.5579897595604		0.248	KNN hi AUC low
C116063	Aldicarb	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999942	0.999999999999136	3.75075168116063e-13		0	
C116255482	Bromuconazole	0	0	0	0	0	0.135	0	0	0.00033	0	0	0	0	0	0	0	0	0	0	0	0.0162	0.0315	0	0	0	0.0149	1.59178248767156e-07	1.11703274833575e-06	5.95193409437497		0	
C116256	1-(Hydroxymethyl)-5,5-dimethylhydantoin	0.00936	0	0	0.00131	0	0	0	0	0	0	0	0	0	0	0	0.0115	0	0.00446	0	0	0.00988	0	0	0.0442	0	0	0.999999999935858	0.999998473117443	6.63117175198862e-07		0	
C1166525	Dodecyl gallate	5.27e-05	0.0773	7.28e-06	0	0	0.000465	0	0	0.0291	0	0	0.0411	0	0	0.00129	0	0	0	0	0	0.00491	0	0	0	0.0137	0	8.77215324128351e-12	5.65663039457273e-15	14.2474421972259		0.269	KNN hi AUC low
C116714466	Novaluron	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000741678916579312	0.00158326820060672	2.80044551079938		0	
C117088	Tetrachlorophthalic anhydride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.74693675440646e-12	2.21778177803223e-12	11.6540811891422		0	
C117337196	Fluthiacet-methyl	0	0	0	0	0	0.000159	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.103	0	0	0	0	0.999999978626164	0.999934584216497	2.84106430670753e-05		NA	
C117395	Quercetin	0.101	0	0	0.00189	0	0.0196	0	0	0	0	0	0	0	0	0	0.00116	0	0.0161	0	0	0.0195	4.32e-07	0	0	0	0	1.94753191502212e-12	4.07663786870623e-20	19.3896978655917		0.538	
C117428225	Picoxystrobin	0	0.00033	0	0	0	0	0	0	0.0909	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0997	5.12957849144394e-05	0.000342257687913883	3.46564678780733		NA	
C117718602	Thiazopyr	0.00886	0	0	2.02e-05	0	0.0887	0	0	0	0	0	0	0	0	0.0018	0	0.000332	0	0	0	0.0388	0	0	0	0	0	0.301673822523042	0.133626607300268	0.874107057929553		0.0183	
C117793	2-Aminoanthraquinone	0.0453	0	0	0	0	0.117	7.1e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00204	0	0	0.0852	0	0	1.9285911680221e-08	4.16335896702064e-07	6.38055614239805		0	
C117806	Dichlone	0	1.96e-20	0	0	0	0.000263	0	0	0.124	0	0	0	0	0	0	0	0	0	0	0	0	0.0263	0	0	0.00379	1.96e-07	1.09216227007262e-19	1.22272401826687e-17	16.9126715567571	EAS hi AUC low	NA	
C117817	Di(2-ethylhexyl) phthalate	0	0	0	0.00039	0	0	0	0	0	0	0	0	0	0	0.0582	0	0	0	0	0	0	0	0	0	0	0	1.03084701774526e-07	1.78218315193412e-09	8.7490476662997		0.00964	
C117840	Dioctyl phthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.23740153966194e-07	8.43616540697842e-09	8.07385491368436		0.0125	
C117997	2-Hydroxybenzophenone	0.0157	0	0	0.00041	0	0.0184	0	0	0	0	0	0	0	0	0.00478	0	0.00159	0	0	0	0.0154	5.89e-05	0	0	0	0	3.10001618970966e-18	2.83795477968305e-23	22.5469945289246	EAS hi AUC med	0.397	KNN hi AUC med
C118134308	Spiroxamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0304219581589845	0.0252453081915691	1.59781932312334		NA	
C118478	1H-Pyrazole-3-carboxylic acid, 4,5-dihydro-5-oxo-1-(4-sulfophenyl)-	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999813607998484	0.977854591136403	0.00972572083829903		NA	
C118525	1,3-Dichloro-5,5-dimethylhydantoin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999945	0.999999949699996	2.18450145555183e-08		0.00936	
C118558	Phenyl salicylate	0	5.79e-06	0	0.0192	0	0	0	0	0	0	0	0	0	0	0.0376	0	0.00462	0	0	0	0	0	0	0	0	0	3.18001766110064e-13	1.82652718731598e-16	15.7383738590593	EAS hi AUC low	0.013	
C118569	3,3,5-Trimethylcyclohexyl salicylate	0.0217	0	0	0.000514	0	0.0361	0	0	0	0	0	0	0	0	0.00189	0	0.00314	0	0	0	0.00997	0.000125	0	0	0	0	1.46893843093452e-16	8.18583019242364e-19	18.08693726864	EAS hi AUC med	NA	
C118581	Benzyl salicylate	0.013	0	0	0.0278	0	0.0035	0	0	0	0	0	0	0	0	0.0186	0.00281	0.00109	0.00147	0	0	0.00307	0	0	0	0	0	2.58711972675355e-12	4.17407146814234e-15	14.379440119249		0.234	KNN hi AUC med
C118718	Maltol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.40070496939034e-12	1.29705376094675e-16	15.8870420226834	EAS hi AUC low	0	
C118796	2,4,6-Tribromophenol	0	0	0	0	0	0.0681	0	0	7.65e-05	0	0	0	0	0	0	0	0	0	0	0	0.0043	0.00044	0	0	0.0317	0	7.16913240329452e-16	2.97457310678763e-20	19.5265753528495	EAS hi AUC low	NA	
C118821	4,4'-Methylenebis(2,6-di-t-butylphenol)	0	0	0	0	0	0	0.000528	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.072	0	0	4.36983895372346e-19	9.5944831626313e-28	27.0179784149528	EAS hi AUC low	0.0193	
C1189088	1,3-Butyleneglycol dimethacrylate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.90587384871831	0.620732595798945	0.207095448421715		NA	
C118934	2-Hydroxyacetophenone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.46871969428416e-19	3.68239207319582e-23	22.4338699729856	EAS hi AUC low	0.0288	
C119073	Octyl decyl phthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.23740153966194e-07	8.43616540697842e-09	8.07385491368436		0.0125	
C1191500	Sodium myristyl sulfate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.555499952708138	0.15311952375881	0.814969430332922		0.093	
C119168773	Tebufenpyrad	0	0.000466	0	0	0	0	0	0	0.125	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.32	0.426028264148279	0.110461038444583	0.956790878289307		NA	
C1192525	4,5-Dichloro-3H-1,2-dithiol-3-one	0	0	0	0.000811	0	0	0	0	0	0	0	0	0	0	0	0.128	0	0	0	0	0	0	0	0	0	0	0.00849879119406803	0.00363809730563893	2.43912568934705		NA	
C119368	Methyl salicylate	0	0	0	0	0	9.24e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0955	0	0	0	0	0	9.82745271560535e-14	7.78468666037807e-17	16.1087588634308	EAS hi AUC low	0.013	
C119446683	Difenoconazole	0	0.000367	0	0	0	0.000631	0	0	0.206	0	0	0	0	0	0	0	0	0	0	0	0	0.0161	0	0	0.00306	6.93e-08	9.27802184324665e-10	1.70269804212327e-09	8.768862363351		0	
C1194656	Dichlobenil	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.22532443977399e-06	7.48054045989771e-07	6.12606702375693		0	
C119471	2,2'-Methylenebis(4-methyl-6-tert-butylphenol)	0.00113	0.000283	0	0	0	0.000628	0	0	0.0809	0	0	0	0	0	0	0	0	0	0	0	0	0.0207	0	0	0.0391	0	7.25222165067293e-20	3.50590936408603e-28	27.4551993156199	EAS hi AUC med	0.0193	
C119515387	Icaridin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999707090217178	0.998187854320131	0.000787718815555763		NA	
C119539	Benzoin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.64554340657845e-20	5.28734951969625e-22	21.2767619796539	EAS hi AUC low	NA	
C119619	Benzophenone	0.04	0	0	0	0	0.00942	2.84e-06	0	0	0	0	0	0	0	0	6.02e-05	0.000121	0	0	0	0.0342	0	0	0.0129	0	0	6.53613414655835e-16	7.82554126117518e-18	17.1064856143423	EAS hi AUC med	0.0491	
C119642	Tetralin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.73744060231806e-16	2.33607135589575e-19	18.6315138957212	EAS hi AUC low	NA	
C119904	3,3'-Dimethoxybenzidine	0	0	0	0	0	2.14e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0806	0	0	0	0	9.06466092938099e-12	4.10533182891483e-12	11.3866517336378		0	
C119937	3,3'-Dimethylbenzidine	0.139	0	0	0	0	0.0152	0	0.166	0	0	0	0	0	0	0	0	0	0	0	0	0.00683	0	0	0	0	0	0.00568596570201079	0.000115727541901103	3.93656327136607	EAS low AUC hi	0.143	
C120068373	Fipronil	0	9.43e-05	0	0	0	0.0341	0	0	0.151	0	0	0	0	0	0	0	0	0	0	0	0.0189	0.000105	0	0	0	0.028	0.982187368182914	0.548409033504238	0.260895400037283		NA	
C120116883	Cyazofamid	0	0	0	0	0	0	0	0.146	0.00388	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.976925380671849	0.626642340494405	0.202980264382744		NA	
C120127	Anthracene	0.0112	0	0	0	0	0.000114	0.000116	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0168	0	0	0.117	0	0	6.68012252844799e-15	1.73912287923619e-18	17.7596697314597	EAS hi AUC med	0.0372	
C120149	Veratraldehyde	0.0572	0	0	0	0	0.00436	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0156	0	0	0	0	1.40363638178004e-15	3.69850039428469e-18	17.4319743306634	EAS hi AUC med	0	
C120183	Naphthalene-2-sulfonic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.96376241941253e-13	2.48579890846109e-15	14.604534007021		0	
C120321	Clorophene	0.0353	0.018	0	1.35e-06	0	0	0	0	0	0	0	0	0	0	0.000516	0	0.000443	0	0	0	0.0447	0	0	0	0	0	2.8883522934842e-18	5.79375391629321e-23	22.2370399549496	EAS hi AUC med	0.138	KNN hi AUC med
C120365	Dichlorprop	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.11598444614687e-11	2.01618347418536e-11	10.6954699493095		0	
C120467	1,3-Diphenyl-1,3-propanedione	0.0491	0	0	0	0	0.0349	1.35e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00477	0	0.0775	0	0	5.65241124730554e-19	1.08773857927795e-18	17.9634754678905	EAS hi AUC med	0.04	
C120478	Ethylparaben	0.0864	2.69e-08	8.99e-06	0	0	0.00902	0	0	0	0	0.035	0	0	0	0.00112	0.000198	0	0	0	0	0.000401	0.000662	0	0.00117	0	0	2.44892053754723e-12	2.52341395210439e-16	15.5980115000301	EAS hi AUC med	0.251	KNN hi AUC med
C120511731	Anastrozole	0.0201	0	0	0	0	0	5.58e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0521	0	0	0.0110577233655417	0.0147244637532171	1.83196051272147		NA	
C120514	Benzyl benzoate	0	2.89e-07	0	0.0392	0	0	0	0	0	0	0	0	0	0	0.00331	0	0.00205	0	0	0	0	0	0	0	0	0	1.1576878827308e-08	5.05127060746082e-11	10.2965993647724		0.0732	
C120558	Diethylene glycol dibenzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.81935387397878e-07	2.74172534767606e-08	7.56197605281528		0.0732	
C120569	Triethylene glycol dibenzoate	0.0732	0	0	0	0	0.179	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000357	0.0184	0	0	0	0	3.51368631489907e-07	3.00040696060902e-08	7.52281983569361		0.00552	
C120616	Dimethyl terephthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.25661003488914e-11	3.78828706033952e-14	13.4215571194265		0	
C120650	2-((Dimethylamino)methyl)phenol	7.52e-06	0	0	0	0	0	0	0.245	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.41871448638149e-13	2.17535601715685e-14	13.6624696565789		0	
C120718	2-Methoxy-5-methylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.03388825402753e-10	1.67922119739816e-11	10.7748920921395		0	
C120729	Indole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.137503313678447	0.0194665259455104	1.71071154705808		0	
C120809	Catechol	0.0155	0	0	0	0	0.025	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0215	0	0	0	0	5.22314631059883e-15	2.29597643348135e-19	18.6390325739664	EAS hi AUC med	0	
C120821	1,2,4-Trichlorobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.40439359910019e-05	2.01455977292665e-07	6.69581984236491		0.00153	
C120832	2,4-Dichlorophenol	0.00424	2.15e-08	0	0.0026	0	0.0367	0	0	0	0	0	0	0	0	0.013	0	0.0145	0	0	0	0.00235	0.00148	0	0	0	0	1.40455530414071e-14	7.33115476413905e-19	18.1348276122355	EAS hi AUC med	0.00613	
C120923	Cyclopentanone	0	1.66e-07	0	0	0.000375	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0773	0	0	0	0	0	0	0.0962437952228112	0.0498131946408188	1.30265560501748		0	
C120956	2,4-Bis(2-methylbutan-2-yl)phenol	0.00528	0.00113	0	1.84e-06	0	0	0	0	0	0	0	0	0	0	0	0	0.0431	0	0	0	0.0965	0	0	0	0	0	9.22010549532677e-19	4.51453988879921e-28	27.3453865053589	EAS hi AUC med	0.282	KNN hi AUC med
C121006	2-tert-Butyl-4-methoxyphenol	0.0139	0	0	0.0101	0	4.16e-06	0	0	0	0	0	0	0	0	0.000412	0.000607	0	0.00123	0	0	0.0244	0	0	0	0	0	8.86453880070893e-19	1.26904827337171e-23	22.8965218574481	EAS hi AUC med	0.0402	
C12108133	Manganese, tricarbonyl[(1,2,3,4,5-.eta.)-1-methyl-2,4-cyclopentadien-1-yl]-	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.330522643743583	0.20037341149034	0.698159907600814		NA	
C121142	2,4-Dinitrotoluene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.170951231522487	0.0327622589052163	1.48462616197116		0.0121	
C121324	3-Ethoxy-4-hydroxybenzaldehyde	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.34280930997834e-15	9.15478746539937e-18	17.0383517336862	EAS hi AUC low	0.0572	
C121335	4-Hydroxy-3-methoxybenzaldehyde	0	0	0.000438	0	0	0	0	0	0	0	0.0654	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.12810082075799e-16	5.6329399678052e-20	19.2492648771669	EAS hi AUC low	0.0572	
C121391	Ethyl 3-phenylglycidate	0	2.39e-05	0	0	0.000775	0	0	0	0	0	0	0	0	0	0	0	0	0	0.127	0	0	0	0	0	0	0	3.20109117479119e-08	6.63889142896731e-08	7.17790443365553		0.00327	
C1214397	N-Benzyladenine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.987721615043577	0.499315759557541	0.301624726392586		NA	
C121552612	Cyprodinil	0.0356	0	0	0	0	0.0122	1.14e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0068	0	0.106	0	0	0.943342913942012	0.379704099014832	0.420554714501199		0	
C121697	N,N-Dimethylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.979198226255669	0.837594920232048	0.076965965190103		0.0518	
C121755	Malathion	0	0	0	0	0	0.0751	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9e-04	0.0329	0	0	0	0	0.999951921087978	0.994975763175715	0.00218749819623075		0	
C121799	Propyl gallate	0.0601	0	0	0.000595	0	0.00705	0	0	0	0	0	0	0	0	0	0	0.00206	0.000129	0	0	0.0451	0	0	0	0	0	4.15340429294953e-12	4.31970199797412e-15	14.3645462126989		0.251	KNN hi AUC med
C121915	1,3-Benzenedicarboxylic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.00446663797136e-16	4.07840061689295e-20	19.3895101161841	EAS hi AUC low	0	
C1219381	Octylparaben	0.268	0	2e-04	0	0	5.64e-05	0	0.043	0	0	0	0.00629	0	0	0	0	0	0	0	0	0.000857	0	0	0.000837	0	0	2.14626405165046e-11	2.87778312096026e-15	14.5409419390024		0.37	
C122008859	Cyhalofop-butyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.9098889674674e-09	4.83719244240124e-09	8.31540663433774		NA	
C122145	Fenitrothion	5.35e-05	0	0	0	0	0.0913	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00865	0.000896	0	0	0.00424	0	7.41789385022341e-09	1.6159703293429e-09	8.79156661752242		0.0868	
C122203	Triisopropanolamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999963672799	0.999588658542451	0.000178680076973278		0.0651	
C122349	Simazine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999998911165	0.999999999982379	7.65285455826099e-12		0.057	
C122394	Diphenylamine	0.00816	0	0	0.00024	0	0.0489	0	0	0	0	0	0	0	0	0.00402	0	0.000169	0	0	0	0.0498	0	0	0	0	0	0.787808929652926	0.284898350962858	0.545310064519048		0.028	
C122407	Pentylcinnamaldehyde	0.00842	0	0	0	0	0.0181	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00684	0.00407	0	0.012	0	0	1.13845235256968e-12	3.7576022393328e-12	11.4250891940081		0.00983	
C122429	Propham	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999986690065082	0.998230246987289	0.000769274881982292		0	
C122453730	Chlorfenapyr	0	0.0311	0	2.37e-05	0	0	0	0	0.000416	0	0	0	0	0	0.000682	0	0.000125	0	0	0	0	0	0	0	0	0.0217	0.901522704551852	0.53165232460116	0.274372282869889		NA	
C122510	Ethyl orthoformate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999990166183	0.996887111458664	0.00135401886627266		NA	
C122576	Methyl styryl ketone	0	0	0	0	0	0.0817	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0248	0	0	0	0	0	1.5845861719231e-12	7.13876774795229e-15	14.1463767471104		0.0167	
C122667	1,2-Diphenylhydrazine	0	0	0	0	0	0.0734	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00888	0.00682	0	0	0	0	0.481396006980669	0.118525321917172	0.926188856454807		0.00816	
C122781	Phenylacetaldehyde	0.0042	0	0	0	0	5.66e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.038	0	0.0237	0	0	1.86642728901721e-17	5.89607164477477e-17	16.2294372478862	EAS hi AUC med	0.0227	
C122836355	Sulfentrazone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999987350765833	0.893202012376382	0.0490503071377988		NA	
C122883	4-Chlorophenoxyacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.89118320017519e-10	4.18909394994398e-11	10.3778798994897		0	
C122996	2-Phenoxyethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.53238995733703e-11	1.86086499213189e-12	11.7302851342841		0	
C123002	4-Morpholinepropanamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999986576	0.999999999991808	3.55759688962296e-12		NA	
C123057	2-Ethylhexanal	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0121674489968188	0.00172026149428787	2.76440553164223		0.0319	
C123079	4-Ethylphenol	0.00352	0	0	4.67e-05	0	3.75e-06	0	0	0	0	0	0	0	0	0.0176	0	0	0	0	0	0.0822	0	0	0	0	0	2.63807618012642e-16	1.04251332878155e-24	23.9819183837602	EAS hi AUC med	0.943	KNN hi AUC med
C123115	4-Methoxybenzaldehyde	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.48420103657266e-15	3.72176388560618e-19	18.4292511826376	EAS hi AUC low	0.0572	
C123122554	Candoxatril	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.1817858310479e-10	3.9996994313452e-10	9.39797264372524		NA	
C123171	2,6,8-Trimethyl-4-nonanol	0.00239	3.24e-05	0	5.75e-05	0	0	0	0	0	0	0	0	0	0.0344	0	0	0	0	0	0	0	0	0	0	0	0	9.00515119289179e-07	6.08893280991693e-09	8.2154588182666		0	
C123251	Diethyl butanedioate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.997822465870019	0.902259319317642	0.0446686234748008		0	
C123312890	Pymetrozine	0	0	0	0	0	0	9.17e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0756	0	0	0.99999663798744	0.956755255458678	0.0191991435163871		NA	
C123319	Hydroquinone	0	0	0	0	0	0.054	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0121	0	0	0	0	9.25296915352695e-15	4.29178272428105e-20	19.3673622727346	EAS hi AUC low	0.0155	
C123331	Maleic hydrazide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.405598687698857	0.124109981288752	0.90619328986055		NA	
C123343168	Pyrithiobac-sodium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0055508818676995	0.004630603462728	2.3343624078039		0	
C123353	Myrcene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.149219406933879	0.0144749539724644	1.83938280857023		NA	
C123422	Diacetone alcohol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00142783850296836	0.000445674565997742	3.35098214976398		NA	
C123660	Ethyl hexanoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.854602785562598	0.370563312023127	0.431137580631348		0.0173	
C123773	Azodicarbonamide	0	0	0	0	0.00044	0	0	0	0	0	0	0	0	0	0	0	0	0	0.102	0	0	0	0	0	0	0	0.999999999999985	0.999999999997134	1.24465746108211e-12		0	
C123922	3-Methylbutyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.982288027212323	0.751074570991644	0.124316941607809		0	
C123966	2-Octanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00316367952761736	6.87144475710443e-05	4.16295194065934		0	
C123999	Nonanedioic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0181910977936981	0.000403011413318783	3.39468265442668		0.00457	
C124049	Hexanedioic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.15761862421956	0.0139881214968555	1.85424060418773		0	
C124072	Octanoic acid	0.00457	0.0142	0	0.0119	0	0	0	0	0	0	0	0	0	0	0	0.00794	0.00133	0.00734	0	0.0206	0	0	0	0	0	0	0.025273338999084	0.000942429477273652	3.0257511384981		0.00386	
C124094	1,6-Hexanediamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.996387901275507	0.999972413379895	1.19808821428615e-05		0.149	KNN hi AUC low
C124130	Octanal	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.130673986605346	0.0170569477432808	1.76809868107273		0.0879	
C124185	Decane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.228578900361412	0.00936329729879869	2.02857118689185		0	
C1241947	2-Ethylhexyl diphenyl phosphate	0.0117	0	0	0	0	0.166	0	0	0	0	0	0	0	0	4.26e-05	0	0	0	0	0	0.00712	0.00428	0	0	0	0	5.43507214392187e-15	1.53577852057328e-16	15.8136714107552	EAS hi AUC med	0.00568	
C124196	Nonanal	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.129300189064397	0.016577487777364	1.78048128362258		0.0879	
C124221	1-Dodecanamine	0.149	0	0	0	0	0	0	0.0876	0	0	0	0	0	0	0	0	0	1.71e-05	0	0.0017	0	0	0	0	0	0	0.994971534389329	0.944494500989918	0.0248005662722555	EAS low AUC hi	0	KNN low AUC hi
C12427382	Maneb	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		0	
C124378774	Enadoline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.01107235369287e-05	3.45857659086309e-05	4.46110260234155		NA	
C124403	Dimethylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999968	1.38863155183676e-14		NA	
C124495187	Quinoxyfen	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0403	0	1.598997489325e-07	2.55902333560747e-06	5.59192575378482		NA	
C124685	2-Amino-2-methylpropan-1-ol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998822377291591	0.908005507753676	0.0419115171399563		0	
C124765	Isoborneol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.53807356337164e-09	8.05855089201173e-14	13.0937430470515		0.248	KNN hi AUC low
C124947	Triamcinolone	0.0939	0	0	0	0	0.0424	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0074	0.00614	0	0	0	0	6.59083457870271e-08	1.27248000474607e-10	9.8953490332715		0.343	KNN hi AUC med
C125116236	Metconazole	0.0105	0.0316	0	0.00939	0	0.071	0	0	0.0119	0	0	0	0	0	0	0	0	0	0	0	0.0105	0.0122	0	0	0	0.00757	2.83183280999343e-10	1.13449410919839e-11	10.9451977548247		0.0268	
C125122	Isobornyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.83624052102227e-06	1.41477057722303e-07	6.84931398072225		0	
C125225287	Ipconazole	0	0.0166	0	0	0	0.000575	0	0	0.00326	0	0	0	0	0	0	0	0	0	0	0	0	0.112	0	0	0.00999	0	1.23163837785374e-09	1.72428238886667e-10	9.76339160748839		0.0268	
C125401925	Bispyribac-sodium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.10907690642424e-06	1.79375525991391e-05	4.74623681241769		0	
C125848	Aminoglutethimide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000306915212225741	0.000726390258677157	3.1388299885937		NA	
C126001	Diphenolic acid	0.174	0	0.058	0	0	0	0	0.0614	0	0	0.00478	0.0192	0	0	0	0	0	0	0	0	7.98e-07	0	0	0	0	0	1.820969434199e-20	1.75831846171139e-25	24.7549024639389		NA	
C1260179	Carminic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.55225663650861e-15	1.10792124391458e-17	16.9554911101391	EAS hi AUC low	NA	
C126067	3-Bromo-1-chloro-5,5-dimethylhydantoin	0	0	0.00194	0	0	0	0	0	0	0	0	0.398	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999947	0.999999949406416	2.19725150948119e-08		0.00936	
C126114	2-(Hydroxymethyl)-2-nitro-1,3-propanediol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999970626718	0.999784758374475	9.34883118904274e-05		0	
C126147	Sucrose octaacetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.42361642153178	0.128154786519401	0.892265168487597		NA	
C126307	2,2-Dimethylpropane-1,3-diol	0	0	0	0	0	0	0.000657	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.126	0	0	0.132226390726309	0.00258006600731747	2.5883691830883		0	
C126727	Tris(2,3-dibromopropyl) phosphate	0	0	0	0	0	0	0.000739	0	0.000291	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0359	0.0638	0	0.999999519265469	0.996681578326353	0.0014435687332874		NA	
C126738	Tributyl phosphate	0	0	0	0	0	0	0.00143	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.148	0	0	0.997204829324195	0.854424953451094	0.0683260765750416		0	
C126833178	Fenhexamid	0.148	0	0	0.000419	0	0.0118	0	0.00241	0	0	0	0	0	0	0.000286	0	0.00058	0.000609	0	0	0.00955	0.000226	0	0	0	0	4.21535060421482e-14	4.06260293370328e-10	9.39119562220433		NA	
C126863	2,4,7,9-Tetramethyl-5-decyne-4,7-diol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000301231631587059	1.29106296766829e-05	4.88905257582499		0	
C126921	Sodium ethasulfate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.208360400955791	0.0456461853735708	1.34059551036255		0.093	
C126987	Methacrylonitrile	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998825909031565	0.999756752953734	0.000105653700429025		NA	
C127071	Hydroxyurea	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999966755	1.44382001277158e-11		NA	
C127195	N,N-Dimethylacetamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999998	1.01254383988095e-15		NA	
C127253	Methyl abietate	0.00607	0	0	4.19e-07	0	0.0149	0	0	0	0	0	0	0.0449	0	0	0	0	0	0	0	0.0141	0	0	0	0	0	1.92571606663106e-06	8.80257845748133e-08	7.0553900953689		0.00244	
C127308821	Zamifenacin	0.0271	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.047	0	0	0	0	0	4.349131631771e-10	9.56345510858801e-10	9.01938517639513		NA	
C127399	Sodium 1,4-diisobutyl sulfosuccinate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999856653668967	0.994353851228598	0.00245903985901605		0	
C127413	alpha-Ionone	0	0	0	0	0	0.0634	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0393	0	0	0	0	0	1.08614470346024e-08	4.65716191510427e-11	10.3318786627299		0.0185	
C127479	Retinol acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.44364990417547e-05	5.62403749260379e-06	5.24995179275767		0	
C127515	alpha-Isomethylionone	0.0185	0	0	0	0	0.109	0	0	0	0	0	0	0	0	0	0	0	0	4.81e-05	0	0.0652	0	0	0	0	0	2.84097369275193e-08	8.29297358917176e-11	10.0812897177233		0	
C128041	Sodium dimethyldithiocarbamate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		0.00506	
C128370	Butylated hydroxytoluene	0	0	0	0	0	0.00126	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.139	0	0	0	0	0	3.70030768071576e-19	1.04925957934212e-27	26.9791170571544	EAS hi AUC low	0	
C128392	2,6-Di-tert-butylphenol	0	0	0	0	0	0.000605	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0387	0	0	0	0	0	5.64929657684067e-19	6.43846232310631e-27	26.1912178413868	EAS hi AUC low	0.00325	
C128639021	Carfentrazone-ethyl	0	0	0	0	0	2.84e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0447	0	0	0	0	0.925921460527263	0.734956113097425	0.133738593444609		NA	
C128950	1,4-Diaminoanthraquinone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.56024945583425e-08	6.1603878492604e-07	6.2103919444117		0.0453	
C129000	Pyrene	0	0	0	0.0337	0	0	0	0	0	0	0	0	0	0	0.00673	0.00277	0	0.00293	0	0	0	0	0	0	0	0	6.89094270965699e-15	8.53166170793316e-19	18.068966373252	EAS hi AUC low	0.0372	
C129066	Sodium warfarin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.16100172206587e-17	1.49280709240618e-19	18.8259963102364	EAS hi AUC low	0	
C129179	Sulfan blue	0	0.000404	0	0	0	0	0	0	0.00345	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.233	0.898858123292446	0.529290722014439	0.276305718729775		0	
C129453618	Fulvestrant	0	0.635	6.67e-05	1.96e-05	0.00935	0	0	0	0.00905	0	0.0232	0	3.49e-05	0	0	0.000272	0	0	0.0234	0	0	0	0	0	0.0173	0	3.67450680322676e-15	7.44622271515672e-24	23.128063978255	EAS hi AUC low	1.06	KNN hi AUC low
C129630199	Pyraflufen-ethyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0418204125087557	0.0218683508545954	1.66018396692826		0	
C1300727	Sodium xylenesulfonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.50024504897212e-09	8.80574260299846e-11	10.0552340133724		0.0123	
C1300738	Dimethylaniline	0	0	0	0	0	1.26e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0356	0	0	0	0	0.00475587109448601	0.000157935262748309	3.80152089274516		0	
C130143	Sodium 1-naphthalenesulfonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.17325601338094e-09	4.40741187103674e-11	10.3558163629322		0	
C1303113	Indium arsenide	0	0	0	0	0	0	0.000453	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0652	0	0	0.999857318611762	0.99854582711149	0.000631998890489954		NA	
C13071799	Terbufos	0.0482	0	0	0.000243	0	0	2.25e-05	0	0	0	0	0	0	0	0.00386	0	0.000958	0	0	0	0.00808	0.000571	0	0.00749	0	0	0.999634551087846	0.974693844740082	0.0111317765267753		0.0181	
C131113	Dimethyl phthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.35022175395819e-11	2.21574895733202e-14	13.6544794463901		0.00932	
C131179	Diallyl phthalate	0.014	0.00157	0	0.00852	0	0.00294	0	0	0	0	0	0	0.00227	0	0.0088	0.00206	0.00372	0	0.00606	0	0.0193	0	0	0	0	0	8.07853959286318e-09	4.28564575973046e-11	10.3679837294567		0	
C131180	Dipentyl phthalate	0.0125	0.0376	0	0.00657	0	0	0	0	0	0	0	0	0	0	0.0262	0.00377	0.00312	0	0.00285	0	0	0	0	0	0	0	4.5033484396239e-07	7.20927369973066e-09	8.14210848619425		0.0265	
C131341861	Fludioxonil	0.0521	0	0	0.000272	0	0	0	0	0	0	0	0	0	0	0	3.62e-05	0.00323	0.000233	0	0	0.0108	8e-09	0	0	0	0	2.35314512570662e-09	4.71853311365879e-07	6.32619299281872		NA	
C131555	2,2',4,4'-Tetrahydroxybenzophenone	0.397	8.24e-08	0.0222	0	0	0	0	0	0	0	0.0334	0.000301	0	0	0	0	0	0	0	0	0.000818	0	0	0	0	0	8.09563850397729e-17	1.72159127379501e-23	22.7640699473103		0.266	
C131566	2,4-Dihydroxybenzophenone	0.266	3.25e-07	0.00365	0	0	0.0216	0	0	0	0.00303	0.0375	0	0	0	0.00186	0.000253	0	0	0	0	0.00103	0	0	0	0	0	8.8114198427457e-17	1.82756906411575e-23	22.7381262020048		0.397	
C131577	2-Hydroxy-4-methoxybenzophenone	0.0645	0	0	0	0	0	0.000109	0	0	0	0	0	0	0	1.17e-05	0	0	0	0	0	0.0113	0	0	0.014	0	0	1.15556210489754e-14	2.03314823628891e-20	19.6918309559142	EAS hi AUC med	0.397	KNN hi AUC med
C131704	Monobutyl phthalate	0	0	7.98e-07	0	0	0	0	0	0	0	0.0675	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.29391559425771e-08	1.07681372661445e-10	9.96785941694354		0.179	KNN hi AUC low
C13171001	1-(6-tert-Butyl-1,1-dimethyl-2,3-dihydro-1H-inden-4-yl)ethanone	0	7.15e-05	0	0.035	0	0	0	0	0	0	0	0	0	0	0	0	0.0021	0	0	0	0	0	0	0	0	0	6.16063892694732e-22	1.13213695811386e-21	20.9461010320212	EAS hi AUC low	NA	
C131807573	Famoxadone	0	0.000714	0	0	0	0	0	0	0.249	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.028	0.000112	3.24529123299983e-08	2.22496329401638e-06	5.65267714932918		NA	
C131860338	Azoxystrobin	0.000129	5.13e-07	0	0	0	0	0	0.167	0.0298	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00557	0.00635	5.26390794889913e-06	5.49908294377959e-05	4.25970972971726		NA	
C13194484	Ethoprop	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999643763531	0.995631586102127	0.00190133398764882		0.0974	
C131983727	Triticonazole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.01856112113077e-11	1.35558011229329e-11	10.8678748113193		0.0268	
C1320076	C.I. Acid Orange 24, monosodium salt	0	0	0	0	0	0.0255	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0129	0	0	0	0	0	3.2547203046742e-10	4.06634409046165e-11	10.3907958745258		0	
C1321740	Divinylbenzene	0	0	0	0	0	2.95e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.038	0	0	0	0	4.88964128840926e-12	8.68769365309041e-16	15.06109550165	EAS hi AUC low	0.0117	
C1323199	Sodium 2,4,7-tri(propan-2-yl)naphthalene-1-sulfonate	0	0	0	0	0	0.0835	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00659	0	0	0	0	0	4.49814797009782e-13	1.04199059719208e-13	12.9821362000442		0.0123	
C1323382	Glyceryl monoricinoleate	0	4.01e-08	0	0	0	0.000504	0	0	0.000302	0	0	0	0	0	0	0	0	0	0	0	0	0.000592	0	0	0.123	0	0.0393578507528922	0.00473678724696096	2.32451612119264		0	
C13254347	2,6-Dimethyl-2-heptanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.55178449700017e-06	8.65350210816184e-08	7.06280809618356		0.00239	
C132649	Dibenzofuran	0.00597	0	0	0	0	1.82e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0424	0	0	0.0605	0	0	3.31015745748874e-17	5.41415113385325e-20	19.2664696252404	EAS hi AUC med	0.0423	
C132650	Dibenzothiophene	0.00373	0	0	4.63e-07	0	0.011	0	0	0	0	0	0	0	0	0.0204	0	0	0	0	0	0.0163	0.000317	0	0	0	0	1.26544105988057e-13	1.13480843524538e-13	12.9450774446713		NA	
C13292461	Rifampicin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.13201040207557e-07	1.42095182926383e-06	5.84742064454931		NA	
C13301616	C.I. Disperse Orange 37	0.000131	0	0	0	0	0.00124	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.247	0	0	0	0	0	0.998265732052445	0.97072792507525	0.0129024767819291		NA	
C133062	Captan	0	0	0	0	0	0	0	0	0.103	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0467	0.944829213896962	0.82418996991516	0.0839726749812978		0	
C133073	Folpet	0	2.33e-07	0	0	0	3.68e-07	0	0	0.108	0	0	0	0	0	0	0	0	0	0	0	0.0143	0	0	0	0	0.031	0.0302702901510024	0.0635447005696211	1.19692066240876		0.00292	
C1330785	Tricresyl phosphate	0	0	0	0	0	0.000618	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.15	0	0	0	0	3.63800885372957e-16	3.12301657161907e-21	20.505425711273	EAS hi AUC low	0.0641	
C1330865	Diisooctyl adipate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.270363486482343	0.03526077596452	1.45270813465153		0	
C13311847	Flutamide	0	0	0	0	0	0	0	0	0.0013	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0925	0.883462573799753	0.633962950760652	0.1979361218507		0	
C1333397	Phenolsulfonic acid	0	0	0	0	0.00178	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.135	0	0	0	0	0	0	6.87131549479581e-13	2.25381127330231e-16	15.6470824531501	EAS hi AUC low	NA	
C1335462	Ionone, methyl-	0	0	0	0	0	0.0998	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0131	0	0	0	0	0	1.33284457009712e-07	2.65940632016379e-09	8.57521530346429		0.0185	
C1338438	Sorbitan, mono-(9Z)-9-octadecenoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.014066635026837	0.00199017427818801	2.70110889105698		0	
C133855988	Epoxiconazole	0	0.0372	0	0.0166	0	0	0	0	6.05e-06	0	0	0	0.000817	0	0.00585	0.00111	0	1.5e-05	0	0	0	0	0	0	0	0.00828	-1	-1	0		NA	
C133904	Chloramben	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.57625695317536e-09	5.29117772733203e-07	6.27644765054444		NA	
C134002601	CP-085958	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.87953546632157e-08	1.21536803747428e-06	5.91529218919248		NA	
C134032	Sodium L-ascorbate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0864223235536139	0.0289700996816908	1.53805001045265		0	
C134203	Methyl 2-aminobenzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.86565771730591e-05	5.6850902875476e-05	4.24526263369		0	
C134316	8-Hydroxyquinoline sulfate	0.00897	0.00019	0	0	0	0	4.45e-06	0	0	0	0.0482	0	0	0	0	0	0	0	0	0	0	0	0.00479	0	0	0	1.02454683889005e-09	3.78196637313823e-09	8.42228233694667		0	
C134523038	Atorvastatin calcium	0	0	0	0	0	0.00105	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0666	0	0	0	0	0	0.0190058753852684	0.0330141942719732	1.48129929743704		NA	
C134605644	Butafenacil	0	0	0	0	0	0	0	0	0.000565	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.125	0.397489904958888	0.206945722957547	0.684143544934305		NA	
C134623	DEET	0	0	0	0	0	0	3.95e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0516	0	0	0.183687581412996	0.0921907517133575	1.03531264381958		NA	
C13463417	Zinc pyrithione	0	0.237	0	0.000338	0	0	0	0	0.00536	0	0	0	0	0.000215	0	6.34e-05	0	0.000389	0	0	0	0	0	0	0.0173	0.000342	0.99043935710578	0.660082586877254	0.180401723880545		0	
C135080034	CP-100829	0	0.0184	1.74e-06	0	0	0	0	0	0	0.0186	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0381	0	0.686537958931942	0.233142386871833	0.632378761610029		NA	
C135158542	Acibenzolar-S-methyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.179317142074047	0.0744603821359727	1.12807473928176		NA	
C135193	2-Naphthalenol	0.0874	0	1.17e-05	0	0	0.022	0	0	0	0	0.0686	0	0	0	0	0	0	0	0	0	0.00175	0	0	0	0	0	1.28580801259083e-18	3.12944726530056e-25	24.5045323623986	EAS hi AUC med	0.25	KNN hi AUC med
C135206	Cupferron	0.0224	0	0	0	0	0.0139	1.09e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00871	0	0.0176	0	0	0.948325676861189	0.594250929451635	0.226030130331123		0.0102	
C135410207	Acetamiprid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999637819633198	0.968594825152079	0.0138578555598698		0	
C136458	Dipropyl pyridine-2,5-dicarboxylate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.23383303492431	0.25409869256103	0.594997569561952		NA	
C136607	Butyl benzoate	0	0	0	0	0	0	0.000367	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0795	0	0	1.0869198411814e-06	4.89317353454444e-08	7.31040938187778		0.179	KNN hi AUC low
C13674845	Tris(2-chloroisopropyl)phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999887691759269	0.964647001683971	0.01563158123366		0	
C13674878	Tris(1,3-dichloro-2-propyl)phosphate	0	0	0	0	0	0	0	0	0.000433	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0613	0	0.999903215569037	0.986388642567259	0.0059519369179661		0	
C136776	4-Hexylresorcinol	0.0687	0.00583	5.05e-06	0.00244	0	0.0217	0	0	0	0	0.0119	0	0	0	3.18e-05	0	0.000207	8.85e-05	0	0	0	0.0223	0	0	0	0	2.90070413268288e-18	1.9314645218559e-25	24.7141132647926	EAS hi AUC med	0.41	KNN hi AUC med
C13680358	4,4'-Methylenebis(2,6-diethylaniline)	1.11e-05	0.0644	0.00252	0	0	0	0	0	0.0237	0	0.2	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00108697637652042	2.4585376149599e-05	4.60932314273499		0.139	KNN hi AUC low
C13684565	Desmedipham	9.96e-05	0	0	0	0	0	0.000913	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.167	0	0	0.061920245113856	0.0312316675609844	1.50540482674645		0	
C13684634	Phenmedipham	0	0	0	0	0	0	0.000439	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.154	0	0	7.93576030609002e-05	0.00067207402263739	3.17258289085613		0	
C137268	Thiram	0.00506	0	0	0	0	0	0	0.143	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		0	
C137304	Ziram	0	0.0644	0	0	0	0	0	0	0.0298	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000965	0	0	0.00144	1	1	0		0.00506	
C137428	Metam-sodium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		0	
C13755298	Sodium tetrafluoroborate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999996249919	0.999875774658368	5.39537316632941e-05		NA	
C137666	Ascorbyl palmitate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00207069215481002	0.000287713930676794	3.54103910971346		0	
C138227	Butyl lactate	0	1.09e-05	0	0	0.00252	0	0	0	0	0	0	0	0	0	0	0	0	0	0.169	0	0	0	0	0	0	0	0.952467006758565	0.562897819823631	0.249570433415478		0	
C138261413	Imidacloprid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999998152210387	0.984506773544754	0.00678129150860577		NA	
C13826352	3-Phenoxybenzenemethanol	0.0657	0	0	0	0	0.0313	0.000147	0	0	0	0	0	0	0	0.000272	0	0	0	0	0	0.0271	0	0	0.00521	0	0	1.29679325968821e-15	1.41943951652634e-17	16.8478831083854	EAS hi AUC med	0.0607	
C138863	Limonene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.25510935915505e-07	7.83670413092581e-09	8.10586654939539		0.0161	
C139026	Sodium phenolate	0	3.45e-06	0	0	0.000505	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0626	0	0	0	0	0	0	3.67018829988675e-13	1.35219305625272e-17	16.8689612985721	EAS hi AUC low	0.0021	
C139139	Nitrilotriacetic acid	0.0176	0	0	0	0	0.00145	0	0	0	0	0	0	0	0.0463	0	0	0	0	0	0	0.103	0	0	0	0	0	0.999999999953451	0.999999992639574	3.19659247640297e-09		0	
C139149556	SB202235	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.24847634871139e-08	8.32883964247381e-07	6.07941549943028		NA	
C139290656	Volinanserin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.85015187466674e-13	1.06074059236803e-12	11.9743908112708		NA	
C139340560	Darbufelone mesylate	0	0	0	0	0	0	0	0	0.0595	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00549	9.34e-08	1.85255554493814e-16	1.98945636876573e-15	14.7012655810273		NA	
C139402	Propazine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999997505322	0.999999995129046	2.11542824458298e-09		0.00394	
C139877	Ethyl diethanolamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999993222045	0.999920425098753	3.45603155948457e-05		0	
C139888	7-Ethyl-2-methyl-4-undecanolsulfate, sodium salt	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00391752690147657	0.000602031463865838	3.22038081069196		0	
C139968	Dodecyl sulfate triethanolamine	7.18e-05	0.000116	0	0	0.00105	0	0	0	0	0	0	0	0	0	0	0	0	0	0.179	0	0	0	0	0	0	0	0.927398278945846	0.772504993962267	0.112098704339056		0	
C140089	Tris(2-chloroethyl) phosphite	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999843043003	0.999392664461955	0.000263842601443131		0	
C140103	Cinnamic acid	0.101	0	0	0	0	0.00112	0	0.0457	0	0	0	0	0	0	0	0	0	0	0	0	0.00101	0.000167	0	0	0	0	5.60939624607776e-16	1.49071222058966e-15	14.8266061882525		NA	
C140114	Benzyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.71373320133168e-08	7.10207458375223e-09	8.14861477118648		0.00188	
C1401554	Tannic acid	0	0	0	2.13e-06	0	0	0	0	0	0	0	0	0	0	0.0327	0	0	0	0	0	0	0	0	0	0	0	1.09152035933471e-11	1.76865278378089e-13	12.7523574180166		0.0601	
C140318	1-(2-Aminoethyl)piperazine	0.0078	0	0	0	0	0	0	0.156	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999963829	0.999999999998284	7.45376915273003e-13		0	
C140385	4-Chlorophenylurea	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998346363279149	0.844277559645989	0.0735147538411174		0	
C140567	Fenaminosulf	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999741343335883	0.985765351081444	0.00622645104089081		NA	
C140647	Pentamidine isethionate	0	0	0	0	0	0.0122	0	0	0.109	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0504	0	2.2138891363698e-11	4.74685962462198e-12	11.3235936111621		NA	
C140669	4-(1,1,3,3-Tetramethylbutyl)phenol	0.393	0	0.00219	0	0.00342	0.000216	2.36e-06	0.0156	0	0.000382	0	0.000839	0	0	0.000543	0	0.00221	0	0.0155	0	0.005	6.46e-05	0	0.0134	0	0	6.09817646030412e-18	1.38649733591236e-28	27.8580809605612		0.491	
C140670	Estragole	0	0	0	0	0	0	0.000385	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0732	0	0	3.1421004085063e-16	7.79291719175757e-21	20.1082999385887	EAS hi AUC low	0	
C140954	Dimethylolurea	0	0	0	0	0	0.000492	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0698	0	0	0	0	0.999999999999899	0.999999999082022	3.98672695352806e-10		NA	
C141048	Diisobutyl adipate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.12	0	0	0	0	0.798547999261864	0.325775410652577	0.487081699097222		0	
C141112290	Isoxaflutole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.42022375042035e-09	9.94130303101868e-06	5.00255668782677		NA	
C141220	9-Octadecenoic acid, 12-hydroxy-, (9Z,12R)-	0	0.0246	0	0	0	0	0	0	1.37e-06	0	0	0.00359	0	0	0	0	0	0	0	0	0	0	0	0	0.0428	0	0.000646183392723132	4.1157340545514e-05	4.38555269571046		0.00166	
C141322	Butyl acrylate	0	0	0	0	0	1.81e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.23e-06	0	0	0	0	0.942737778513083	0.803083623158327	0.0952392303310946		NA	
C141435	Ethanolamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999993758694	0.99943920676551	0.000243617723199402		NA	
C141517217	Trifloxystrobin	0	0	0	0	0	0	0	0	0.105	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.083	0	4.74428809509599e-10	1.30906951307821e-08	7.88303729130659		0.0154	
C141662	Dicrotophos	7.97e-05	0	0	0	0	0.00119	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.148	0	0	0	0	0.999999999951383	0.999999999398399	2.61272183749632e-10		0	
C141797	4-Methylpent-3-en-2-one	0.14	0.000626	0	0.00229	0.00098	0	0	0.00636	0	0	0	0	0	0	0	0.00452	0	0.0387	0	0.0138	0	0	0	0	0	0	0.34338364507948	0.0632853819587273	1.19869659437152	EAS low AUC hi	NA	
C142041	Aniline hydrochloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.393894366506419	0.079000881242047	1.10236806419787		0.0201	
C142165	Bis(2-ethylhexyl) maleate	0	0	0	0	0	0.000434	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.114	0	0	0	0	0.0476222289367459	0.0107166536569553	1.96994080468019		0	
C142187	1-Monolaurin	0	0	0	0	0	0	0	0	0.000531	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0546	0	0.214073216299751	0.031912298282436	1.49604191735344		0	
C142314	Sodium octyl sulfate	0	0	0	0	0	0.136	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0117	0	0	0	0	0.555499952708138	0.15311952375881	0.814969430332922		0.093	
C14233375	1,4-Bis(N-isopropylamino)anthraquinone	0	0	0	9.97e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0877	0	0	0	0	0	0	0	0	3.27720526122054e-05	0.000271854055342534	3.56566418409045		0.0453	
C142459583	Flufenacet	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999978998	0.999959270403348	1.76889993116605e-05		NA	
C142621	Hexanoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.149777593980927	0.0179405431101717	1.74616441379023		0.00457	
C142870	Sodium decyl sulfate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.555499952708138	0.15311952375881	0.814969430332922		0.093	
C143077	Dodecanoic acid	0	0.017	0.000518	0	0	0	0	0	0	0	0	0.154	0	0	0	0	0	0	0	0	0	0	0	0	0.0412	0	0.0238213057034656	0.000903548162824852	3.044048692808		0.248	KNN hi AUC low
C143088	1-Nonanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0232132941280827	0.000330728057969953	3.48052895929064		0.00481	
C143226	2-[2-(2-Butoxyethoxy)ethoxy]ethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.970008132868645	0.320517011593994	0.49414891514568		0	
C143390890	Kresoxim-methyl	0.0154	0.066	0	0	0	0.0248	0	0	0	0	0	0	0	0	0	0.000424	0	0	0.000183	0	0.0406	0	0	0	0.00523	0	1.25312706678488e-10	6.21766348772751e-11	10.206372786535		0	
C1434544	Pregnenolone carbonitrile	0	0	0.00169	0	0	0	0	0	0	0	0	0.214	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.52709615614682e-08	9.66910362661282e-12	11.014613785282		0.4	KNN hi AUC low
C143500	Kepone	0.174	0.0149	0.00846	0	0	0	0	0	0	0	0.00762	0.0254	0	0	0	0	0	0	0	0	0.00621	0	0	0.0028	0	0	9.07254091767679e-09	8.08786844254632e-12	11.0921659216036		NA	
C14351667	Sodium abietate	0.00244	0.0112	0	0	0	1.85e-05	0	0	0	0	0	0	0	0.0108	0	0	0	0	0	0	0.0828	0	0	0	0.0316	0	1.77144800155825e-07	1.67263277463096e-09	8.77659939762541		0.00607	
C14371109	(2E)-3-Phenylprop-2-enal	0.0167	0	0	0	0	0.00963	4.03e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0311	0	0	0.0173	0	0	2.00022621733223e-11	7.89147012583024e-14	13.1028420832214		0	
C143748	Phenol red	0.0409	0	0.0301	0	0	0.0134	0	0	0	0	0.0232	0.0318	0	0	0	0	0	0	0	0	3.11e-05	0	0	0.00017	0	0	2.81588195022065e-18	6.07239527337912e-23	22.2166399664505	EAS hi AUC med	0	
C144490	Fluoroacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.988780011578849	0.737542976339885	0.132212668443398		0	
C144550367	Iodosulfuron-methyl-sodium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.017999951107253	0.0253231310951895	1.59648259670793		0	
C1445756	Diisopropyl methylphosphonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999931688962377	0.98732028676774	0.00554193931456806		NA	
C144627	Oxalic acid	0.00766	0.0225	0	0.0062	0	0	0	0	0	0	0	0	0	7.78e-07	0	0.00842	0	0.0204	0	0	0	0	0	0	0	0	0.950841142641862	0.575181759388246	0.240194895091517		0	
C145701219	Diclosulam	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999001441827	0.981288574657458	0.00820325770493965		0	
C145733	Endothal	0	0	0	0	0	6.07e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0807	0	0	0	0	5.59732149447036e-06	9.52113326685006e-07	6.02131135600128		NA	
C145742285	CP-122721	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0393	6.60800521970442e-12	2.66961292092623e-10	9.57355170436293		NA	
C1459934	Dimethyl isophthalate	0	0	0	0	0	1.62e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0343	0	0	0	0	3.28430345995445e-11	1.20075697163975e-13	12.9205448831517		0.035	
C1461229	Tributyltin chloride	0	0.114	0	0	0	0	0	0	0.128	0	0	0	0	0	0	0	0	0	0	0	0	0	1.24e-05	0	0.000479	0.00686	0.998574225642142	0.876402999608915	0.0572961446766332		0	
C1461252	Tetrabutyltin	0	0.0101	0	0	0	1.67e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0468	0	0	0	0.0871	0.993551758568463	0.79459677582681	0.099853201479833		0	
C147240	Diphenhydramine hydrochloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.13804760988601e-09	1.10365270667276e-08	7.95716756728079		0.0199	
C14765301	2-sec-Butylcyclohexanone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.78839719291144e-06	1.30864890486227e-07	6.883176853933		0.0491	
C1477550	1,3-Benzenedimethanamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000430744349982139	4.72975349612599e-05	4.32516149310192		NA	
C147819	Arabinose	0	1.59e-05	0.00168	0	0	0	0	0	0	0.604	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.12578900694311	0.016301872556022	1.78776250639125		NA	
C1478611	Bisphenol AF	0.552	2.6e-05	0.0192	0.000296	0	3.14e-05	3.79e-08	0.00233	0	2.61e-07	0.011	0.00983	3.43e-05	0	0.00513	0.00262	0	0	0	0	0.00403	0.000119	0	0.00264	0.000808	0	1.15267084568884e-17	1.64798774608568e-27	26.783046021903		0.491	
C14816183	Phoxim	0.156	0	0	0	0	0.022	0	0.00206	0	0	0	0	0	0	0	0	0	0	0	0	0.0188	0	0	0.00085	0	0	0.000248514124975095	0.00061830973796538	3.20879391359925	EAS low AUC hi	NA	
C148243	8-Hydroxyquinoline	0	0	0	0	0	4.88e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.039	0	0	0	0	1.60985842867707e-11	4.07702980957827e-11	10.3896561131522		0.00897	
C148477718	Spirodiclofen	0	0	0	0	0	0	5.49e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0502	0	0	3.80224709309015e-10	1.77934022498588e-09	8.74974100317701		0	
C148798	Thiabendazole	0	0	0	0	0	0	0.00148	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.233	0	0	0.99879765770657	0.558892343959354	0.25267183956817		0	
C1490046	Menthol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.20548412045432e-10	5.62039953124481e-13	12.2502328111129		0.00239	
C14901076	4-(2,6,6-Trimethyl-cyclohex-1-enyl)-but-3-en-2-one	0	0	0	0	0	0.000479	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0692	0	0	0	0	0	9.89583511897343e-11	4.34265691982032e-13	12.362244479575		0.0185	
C149062759	PharmaGSID_47259	0	0	0	0	0	0	0.00127	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.13	0	0	0.84336503148703	0.545325097825352	0.263344514056752		NA	
C149304	2-Mercaptobenzothiazole	0	0	0	0	0	0.0128	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0623	0	0	0	0	0.992990862825643	0.463313391033848	0.334125147308042		0	
C149575	2-Ethylhexanoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00353580117916646	0.000435871609002469	3.36064141833061		0.011	
C149877418	Bifenazate	0	0	0	0	0	0	0	0	0.0512	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00644	0.000402	3.2242845397163e-09	1.96497635450416e-07	6.70664267132934		NA	
C149979419	Tepraloxydim	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.4711066974249e-06	3.25318848214589e-06	5.48769077398081		0	
C150130	4-Aminobenzoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.46805901718409e-10	2.78863545144371e-09	8.55460825582156		0	
C15046750	Sodium 2-methylbenzenesulfonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.46718186876112e-06	2.88936148225218e-08	7.5391981210403		0.0123	
C150685	Monuron	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999988828081291	0.966012299747996	0.0150173438964357		0	
C150765	4-Methoxyphenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.01189085654404e-13	4.13742857542035e-16	15.3832694903929	EAS hi AUC low	0	
C150787	Hydroquinone dimethyl ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.42328672820797e-12	1.58797231218221e-14	13.799157074183		0	
C151053	Dimethylbenzylcarbinyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.72594168229856e-13	2.38480821579568e-12	11.6225465408044		0	
C151213	Sodium dodecyl sulfate	0	0	0	0	0	0.000385	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0401	0	0	0	0	0	0.555499952708138	0.15311952375881	0.814969430332922		0.093	
C15214898	2-Acrylamido-2-methyl-1-propanesulfonic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999876984	0.999999946112151	2.34031960759184e-08		NA	
C15299997	Napropamide	0	2.68e-07	0	0	0	0.128	0	0	3.39e-05	0	0	0	0	0	0	0	0	0	0	0	0.00244	0.000345	0	0	0	0.0249	4.20119609345613e-09	6.0911001016739e-07	6.21530426320628		NA	
C15307796	Diclofenac sodium	0	2.58e-07	0	0	0	0	0	0	0.00142	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.115	0	0.00523298217168018	0.0144219849160477	1.8409749630034		NA	
C15310017	Benodanil	0	0	0	0	0	6.25e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0927	0	0	0	0	0.163230077477025	0.050646667845902	1.29544912253947		NA	
C153233911	Etoxazole	0	0	0	0	0	0	0	0	0.00145	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0617	0	1.72465673268461e-12	2.30818314190855e-10	9.63672973521961		NA	
C153719234	Thiamethoxam	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999997	0.999999999999952	2.08294732775515e-14		0	
C1541817	4-Dodecylmorpholine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999958816470199	0.999762430763599	0.000103187265984316		0	
C154427	6-Thioguanine	0	0	0	0	0	0	0	0	0.00213	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.158	0	0.999999924919839	0.997791483253225	0.000960207344034856		NA	
C15499271	4-Butylchlorobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.35239118772847e-10	1.79419217335023e-12	11.7461310421415		0	
C155569918	Emamectin benzoate	0	5.68e-21	0	0	0	0	0	0	0.157	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0401	0	1.02621075147068e-05	1.34018275257825e-05	4.87283597549747		0	
C1559348	3,6,9,12-Tetraoxahexadecan-1-ol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.970008132868645	0.320517011593994	0.49414891514568		0	
C1559359	2-(2-Ethylhexyloxy)ethanol	0.000532	0	0	0	0	0.132	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00102	0	0	0	0	0.0415898953870337	0.00279347203261537	2.55385567230511		0	
C155990208	SR271425	0.0558	0	0	0	0	0.000305	0.00219	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00336	0	0.013	0	0	6.85402790148459e-05	0.000429405159332361	3.36713274179052		NA	
C156052685	Zoxamide	0	0.038	0	0	0.0496	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00317	0.00378	0	0	0	0	0	0	0.00400665360221451	0.00416156332889285	2.38074349207286		NA	
C156105	4-Nitrosodiphenylamine	0.028	0.0138	0	0	0	5.74e-07	0	0	0	0	0	0	0	0	0	0	0	0	0.0215	0	0.0145	0	0	0	0	0	0.839466589855367	0.294369273904267	0.531107523377445		0.0102	
C1563388	2,3-Dihydro-2,2-dimethyl-7-benzofuranol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.71021961869403e-19	9.48104283636372e-22	21.0231438912305	EAS hi AUC low	0	
C1563662	Carbofuran	0	0	0	0	0	0	0.000443	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0721	0	0	6.02054140594328e-14	1.30031519620999e-13	12.8859513620143		0.0115	
C156434	4-Ethoxyaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.71035061310024e-06	1.16519611430592e-06	5.93360097232648		0.00848	
C156605	(E)-1,2-Dichloroethylene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.908548273391316	0.927089349111362	0.0328784082976931		NA	
C1569013	1-Propoxy-2-propanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.973519636324827	0.358617041163744	0.445369076994877		0.0156	
C1569024	1-Ethoxy-2-propanol	0.000721	0	0.000197	0	0	0	0	0	0	0	0	0.0789	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.989580924269074	0.353997670634506	0.450999595697118		0.0156	
C1570645	4-Chloro-2-methylphenol	0.0109	4.17e-07	0	0.0108	0	0.0363	0	0	0	0	0	0	0	0	0.0238	2.88e-05	0.000712	0.00251	0	0	0.00234	0.00203	0	0	0	0	2.99664057500586e-17	8.95162334564505e-22	21.0480981997538	EAS hi AUC med	0.138	KNN hi AUC med
C15708415	Ethylenediaminetetraacetic acid ferric sodium salt	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.99999999999999	4.38768997281748e-15		0.0176	
C158081993	CP-105696	0	0.0249	0.000835	0	0	0	0	0	0	0	0	0.153	0	0	0	0	0	0	0	0	0	0	0	0	0.0607	0	1.41351553644542e-17	1.03391903977947e-19	18.9855134669999	EAS hi AUC low	NA	
C1582098	Trifluralin	0.0337	0	0	0	0	0	0	0.115	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.828481811617224	0.693244664945852	0.159113463969347		0.0398	
C159138815	Cariporide mesylate	0.0124	3.21e-07	0	5.86e-05	0	0.0605	0	0	0	0	0	0	0	0	0.0745	0	0	0	0	0	0.00561	5.89e-06	0	0.00265	0	0	0.000103852528433393	0.00111717260949567	2.95187972074288		NA	
C1596845	Daminozide	0.0318	0.000412	0	0.0032	0	0	6.49e-06	0	0	0	0	0	0	0	0	0.00417	0.000284	0.00711	0	0	0	0	0	0.0295	0	0	0.999997337688282	0.999991586382374	3.65400307959798e-06		NA	
C15972608	Alachlor	0	0	0	0	0	0	0	0	0.00129	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0874	0	0.969974343412498	0.859165709096431	0.0659230648002301		0	
C16079882	Bromo-3-chloro-5,5-dimethylhydantoin	0	0	0	0	0	0	0	0.163	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999947	0.999999949406416	2.19725150948119e-08		0.00936	
C1610180	Prometon	0	0	0	0	0	0.136	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0039	9.06e-05	0	0	0	0	0.999999999988683	0.999999999310889	2.9927714890937e-10		0	
C161050584	Methoxyfenozide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.06520493628607e-10	5.55924680166712e-08	7.25498404511544		NA	
C161326347	Fenamidone	0.0164	2.11e-05	0	0	0	0.00464	0	0.000523	0.0677	0	0	0	0	0	0	0	0	0	0	0	0.00489	0	0	0	0.00926	0.0172	0.691410814326019	0.273114964728939	0.563654503005099		NA	
C16219753	5-Ethylidene-2-norbornene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.86964406470125e-07	3.37201973638756e-09	8.47210989211992		0	
C1625918	4,4'-Di-tert-butylbiphenyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.1988167735793e-15	1.37055550568644e-20	19.8631033714158	EAS hi AUC low	0.0234	
C162706141	UK-156819	0	0	0	0	0	0	1.64e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.062	0	0	0.0643261328418586	0.0920163326232637	1.03613507984343		NA	
C1632731	Fenchol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.48050256219579e-10	3.12339857598218e-15	14.5053725920411		0	
C1634782	Malaoxon	0	0	0	0	0	3.87e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0445	0	0	0	0	0.999939204618167	0.993633848221835	0.00277362263691682		0	
C163520330	Isoxadifen-ethyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.86536803896514e-09	5.14083120624395e-08	7.2889666554989		NA	
C1638228	4-Butylphenol	0.111	0	0	0	0	0.028	0	0	0	0	0	0	0	0	0.00295	0	0.00301	0	0	0	0.00163	0.00419	0	0.000428	0	0	4.89699700555797e-16	3.2446560643706e-24	23.4888313319183		0.41	
C16423680	FD&C Red 3	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0137	0	0	0	0	7.08013521448346e-13	1.58056250926102e-17	16.8011883236837	EAS hi AUC low	0.538	KNN hi AUC low
C1646759	Aldicarb oxime	0	0	0	0	0	0	5.67e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0717	0	0	0.99603808344124	0.986457583642844	0.00592158409237064		NA	
C1646873	Aldicarb sulfoxide	0	0	0	0	0	4e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0398	0	0	0	0	0.999999999999996	0.999999999999926	3.2353186502864e-14		0	
C1646884	Aldoxycarb	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999998	0.999999999999891	4.75413441010797e-14		0	
C165252700	Dinotefuran	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999999453256	0.999999999317625	2.96351765104828e-10		NA	
C16587716	4-(tert-Pentyl)-cyclohexanone	0.0437	3.01e-05	0.00288	0	0	0	0	0	0	0.00957	0.029	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.22490245572536e-07	2.37712373757614e-09	8.62394821114188		0.0491	
C166412788	Diisononyl cyclohexane-1,2-dicarboxylate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00570771551674248	0.000744134862479316	3.12834834842882		0	
C16672870	Ethephon	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998624582993688	0.899801258951164	0.0458534035296863		NA	
C1671756	Heptanophenone	0.00686	0	0	0	0	0.0102	8.95e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0105	0	0	0.0335	0	0	2.24679422493207e-14	2.05114805471491e-14	13.6880029905214		0.00983	
C16752775	Methomyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		0	
C1675543	Bisphenol A diglycidyl ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.067694124709e-16	3.55884499188551e-20	19.4486909276002	EAS hi AUC low	NA	
C16893859	Sodium hexafluorosilicate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999906243	0.999853211975441	6.37539083450802e-05		NA	
C1689845	Bromoxynil	0	2.71e-05	0	0	0	0.000261	0	0	3.87e-05	0	0	0	0	0	0	0	0	0	0	0	0	0.0644	0	0	0	0.0476	1.35268845886342e-17	4.21706252404202e-22	21.3749899598945	EAS hi AUC low	0	
C169590425	Celecoxib	0	0.0159	0	0.0669	0	0	0	0	0	0	0	0	0	0	0	0.0022	0.00841	0.00439	0	0	0	0	0	0	0.00884	0	0.859954759432164	0.150391582356833	0.822776471179781		NA	
C1698608	Chloridazon	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.954230315561653	0.392995793259046	0.405612098413788		0	
C1702176	Clopyralid	0	0	0	0	0	0	0.000306	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0831	0	0	0.057521158750832	0.0189237044281317	1.72299384387405		0	
C171866312	CP-283097	0.0212	0	0	0	0	0	1.59e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00798	0	0	0.292	0	0	6.89404913149518e-15	3.4175955332566e-15	14.4662793366032		NA	
C1724396	Cyclododecanol	0.0221	0	0	0.00484	0	0.0286	0	0	0	0	0	0	0	0	0.002	0	0.00296	0.0023	0	0	0.0156	9.16e-06	0	0	0	0	3.00507555800872e-05	2.47454535979649e-07	6.6065045809198		0	
C173584446	Indoxacarb	0	0	0	0	0	0	0	0	0.000464	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.116	0	0.00162102357178351	0.00249601956303625	2.60275201510925		NA	
C17372871	Eosin	0	0.000439	0	0	0	0	0	0	0.00304	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.206	0	8.08975297113141e-13	3.92146076563341e-17	16.4065521257652	EAS hi AUC low	0	
C1742149	1,1-Bis(3,4-dimethylphenyl)ethane	0	0	0	0	0	1.28e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0536	0	0	0	0	1.26217122301535e-14	7.49171740467179e-18	17.1254186130248	EAS hi AUC low	0	
C17465860	gamma-Cyclodextrin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00648763209053463	0.000396341589628667	3.40193035310478		0	
C175013180	Pyraclostrobin	0	0.000357	0	0	0	0	0	0.0214	0.142	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0642	0.00249	0.611006017356228	0.252620982199312	0.597530580641584		NA	
C1760243	N-[3-(Trimethoxysilyl)propyl]ethane-1,2-diamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999998693063	0.99999999996176	1.66073101146849e-11		NA	
C1762954	Thiocyanic acid, ammonium salt	0	0	0	5.24e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0.107	0	0	0	0	0	0	0	0	1	0.999999996638858	1.45972558421771e-09		NA	
C1763231	PFOS	0.000259	0.00114	0	0	0	0.00805	0	0	0.000329	0	0	0	0	0	0	0	0	0	0	0	0	0.00838	0	0	0.0507	0	0.206708152090382	0.00145154811377651	2.83816856424062		0.024	
C17696627	Phenylparaben	0.275	5.68e-07	0.0235	0	0	0	0	0.01	0	0	0.000721	0.0481	0	0	0.00215	0	0	0	0	0	0	0	0	3.83e-06	0	0	4.70041671361212e-14	2.1466346912422e-18	17.6682418563911		0.234	
C177785476	PharmaGSID_47261	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0033845062314172	0.0155807774319979	1.80741087618828		NA	
C17796826	N-(Cyclohexylthio)phthalimide	0.00292	0.0032	0	0	0	0.00347	0	0	0	0	0	0	0	0	0	0	0	0	0.00125	0	0.0331	0	0	0	0.0129	0	0.0194160636948738	0.0381952227932013	1.41799095238389		0	
C17804352	Benomyl	0	0	0	0	0	0	0.00297	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.108	0	0	0.999999999834622	0.999992617750871	3.20608189467535e-06		0	
C17924924	Zearalenone	0.71	0	0	0	0	0	4.27e-06	0	0	0	0.000149	0	0	0	0.000239	0	0	0	0	0	0.0185	0	0	0.0372	0	0.00127	3.81083742286787e-15	5.85428537742291e-18	17.2325261109389		NA	
C179465715	CJ-013790	0.0185	0	0	0	0	5.29e-06	8.13e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.13	0	0	0.0099	0	0.0167	9.39203503483733e-06	3.99933521243307e-05	4.3980121930636		NA	
C180084019	SB236057A	0	0.0595	0	0	0	0	0	0	0.00569	0	0	0	0	0	0	0	0	0	0.00215	2.54e-07	0	0	0	0	3.59e-06	2.02e-05	2.93293668934248e-05	0.000114571786615347	3.94092231453086		NA	
C1806264	4-Octylphenol	0.118	0	0	2.04e-05	0	0.00191	0	0	0	0	0	0	0	0	0.000957	0	0.000949	0.000236	0	0	0.048	0	0	0.00163	0	0	8.59248549480366e-16	1.03186477239053e-24	23.9863772140002		0.41	
C181274157	Propoxycarbazone-sodium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0359139768243412	0.0663870873206229	1.17791638525171		NA	
C181274179	Flucarbazone-sodium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0167336514799007	0.0148375966336534	1.82863643957395		NA	
C181640095	SR144190	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0544161118085143	0.0153652601435353	1.81346008246615		NA	
C18172673	(-)-beta-Pinene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.54871225876869e-11	5.39975765272418e-15	14.2676257313708		0	
C1825214	Pentachloroanisole	0	0	0	0.0696	0	0	0	0	0	0	0	0	0.000513	0	0.0222	0	0.015	0	0	0	0	0	0	0	0	0	1.18527692016002e-11	1.10111130607535e-13	12.9581687780573		0.00613	
C1836755	Nitrofen	0	0	0	0	0	0.196	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.051	0.000593	0	0	0	0	3.74338938223179e-05	1.1847163950182e-05	4.92638560140058		NA	
C1843056	Octabenzone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.24056681191428e-15	3.42135805268195e-18	17.4658014735592	EAS hi AUC low	0.268	KNN hi AUC low
C184653847	Carabersat	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.7040682352191e-13	5.22615285717137e-11	10.2818178919575		NA	
C1861321	Chlorthal-dimethyl	0	0	0	0.025	0	0	0	0	0	0	0	0	0	0	0.0128	0.0071	0.00693	0	0	0	0	0	0	0	0	0	2.06924115329592e-11	5.01539140995325e-12	11.2996951682169		0	
C1861401	Benfluralin	0.0398	5.32e-07	0	1.4e-05	0	0	0	0	0	0	0	0	0	0	0.00724	0	0	0	0.0139	0	0.00218	0	0	0	0	0	0.811411768037766	0.758465199707887	0.120064340943899		0.0346	
C186392654	Ingliforib	0	2.63e-05	0	0	0	0	0	0	3.63e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0579	0	0.873804702058683	0.127933872336694	0.893014454572747		NA	
C1873887	1,1,1,3,5,5,5-Heptamethyltrisiloxane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999992669822	0.99968660303003	0.000136127906854107		0	
C188425856	Boscalid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.543498109828078	0.13568120613527	0.867480304418406		NA	
C188489078	Flufenpyr-ethyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.220033768300366	0.0784393792407752	1.10546585194169		0	
C189003927	Trelanserin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.969456824642785	0.292961398306449	0.533189600147358		NA	
C18924668	2,2'-(Tetradecylimino)diethanol	0	0.0742	0.0299	0	0	0	0	0	0	0.0439	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.990758406085472	0.951714006984763	0.0214935388513802		0	
C1897456	Chlorothalonil	0	2.73e-05	0	0	0	0	0.000479	0	0.072	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0396	0	0.0375	0	1.49712366293875e-06	1.6675036853681e-07	6.77793319757138		0	
C18979550	4-(Hexyloxy)phenol	0.161	3.4e-08	0.00103	0	0	0	0	0	0	0	0	0.155	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.39035029250662e-11	4.26799824858638e-13	12.3697757674644		0.00257	
C19044883	Oryzalin	0	0	0	0	0	0	0	0	0.000528	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0969	0	0.999983533588592	0.995920295581312	0.00177541717301331		NA	
C1907659	N-Butyl-p-toluenesulfonamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00854765771592135	0.00434481684982478	2.36202852595569		0	
C1912249	Atrazine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999718586	0.999999999996621	1.46760997134993e-12		0.057	
C1918009	Dicamba	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.55323914744565e-14	1.50264677620286e-15	14.8231430960429		NA	
C1918021	Picloram	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.414323975773108	0.0979458358486109	1.0090140232365		0	
C1918167	Propachlor	0	0.000365	0	0	0	0	0	0	0.093	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0559	0	0.999999928073461	0.999443358657795	0.000241813571279999		NA	
C1929733	2,4-D-Butotyl	0	0	0	0	0	0	0.000455	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.104	0	0	3.81893633735061e-06	2.08985128387688e-06	5.67988461766388		0	
C1929777	Vernolate	0	9.7e-09	0.00108	0	0	0	0	0	0	0	0.176	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.99999999999722	1.20724155537974e-12		0.00391	
C1929824	Nitrapyrin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.935548336844526	0.4894744364132	0.310269984993822		0	
C1934210	FD&C Yellow 5	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.970488610180859	0.472074244303952	0.325989693408609		NA	
C1936158	C.I. Acid Orange 10	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.98079582343496e-11	2.33714040081688e-13	12.6313151971206		0	
C194098254	CP-409092	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.353117498323733	0.0837487527914733	1.07702165187099		NA	
C1948330	tert-Butylhydroquinone	0.00291	0	0	0	0	1.11e-05	0	0	0	0	0	0	0	0	0	0	0.000444	0	0	0	0.14	0	0	0	0	0	3.46319884201327e-19	7.98962532513584e-27	26.0974735865235	EAS hi AUC med	0.0402	
C19666309	Oxadiazon	0	0	0	0	0	5.52e-05	0	0	0.0649	0	0	0	0	0	0	0	0	0	0	0	0	0.0432	0	0	0	0	0.0216948110928316	0.0160143164195913	1.79549159471702		NA	
C196808454	Farglitazar	0	7.61e-06	0	0	0	0.0068	0	0	0.00137	0	0	0	0	0	0	0	0	0	0	0	0	0.457	0	0	0.0852	0	6.8816518833873e-07	3.53976554884504e-06	5.45102550187669		NA	
C197077557	UK-333747	0	0	0	0	0	0	0.000705	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.072	0	0	0.999915403583921	0.78346515312802	0.105980315265292		NA	
C19774824	Amiodarone hydrochloride	0	1.1e-07	0.00136	0	0	0	0	0	0	0	0	0.146	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.40107612802566e-11	4.0770663451893e-11	10.3896522213133		NA	
C19780111	(2-Dodecenyl)succinic anhydride	0	0	0	0	0	0	0	0	0.00144	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0905	0	0.0375413268877283	0.00609026002809783	2.21536416445133		NA	
C1987504	4-Heptylphenol	0.113	0	0	0	0	0.0151	0	0	0	0	0	0	0	0	0.000364	0	0.000736	2.32e-06	0	0	0.0113	0.00168	0	0.000822	0	0	8.48020707384347e-16	1.41363910505009e-24	23.8496614495847		0.435	
C199119589	Trifloxysulfuron-sodium	0.00375	0	0	0	0	0	2.45e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00466	0	0.0729	0	0	0.9981322679709	0.772385522659356	0.112165875089534		NA	
C199171885	CP-401387	0	0	0	0	0	9.65e-05	0	0	0.00261	0	0	0	0	0	0	0	0	0	0	0	0	0.0471	0	0	0.15	0	1.28009826578496e-05	0.000145289454051397	3.83776590816243		NA	
C199584388	1-Methoxy-4-tert-pentylcyclohexane	0	0	0	0	0	0.0462	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.386	0	0	0	0	1.47547737853314e-08	2.52985379688992e-10	9.59690457646791		0.248	KNN hi AUC low
C2008415	Butylate	0	0	0	0	0	9.08e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0887	0	0	0	0	1	0.999999999998949	4.56319757173255e-13		0.00391	
C200940234	SB243213A	0	0	0	0	0	0.000109	0	0	0.00144	0	0	0	0	0	0	0	0	0	0	0	0	0.0598	0	0	0	0.0753	0.119536531573336	0.0409695035874243	1.38753929820328		NA	
C2016571	1-Decanamine	0	0	0	0	0	0.000305	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.131	0	0	0	0	0.80251109766853	0.919097276448374	0.0366385208347851		0.149	KNN hi AUC low
C20265978	4-Methoxyaniline hydrochloride	0	0.000182	0	0	0	0	0	0	0.0014	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.143	0	4.03426380623771e-07	1.15514909403508e-07	6.93736195816328		0.00457	
C2031676	Triethoxymethylsilane	0	0	0	0	0	0.000255	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0577	0	0	0	0	0	0.99999998222777	0.997841322921569	0.000938514883498555		0	
C20325400	3,3'-Dimethoxybenzidine dihydrochloride	0	0	0	0	0	0.000657	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.267	0	0	0.0284	0	1.41860336295795e-11	8.5176340373596e-12	11.069681023451		0	
C203942498	UK-337312	0.0021	0.0124	1.59e-06	0	0	0	0	0	0	0	0.0451	0	0	0	0	0	0	0	0	0	0	0	0.0231	0	0	0.00205	0.0412109936493847	0.0173701195348712	1.7601971928853		NA	
C2043574	1H,1H,2H,2H-Perfluorooctyl iodide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.115834191076948	0.00637548495705005	2.19548677463357		NA	
C2044646	N,N-Dimethylacetoacetamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999834313	0.999999562448935	1.90026054480873e-07		NA	
C2058460	Oxytetracycline hydrochloride	0	0	0	0	0	8.07e-05	0	0	0.000449	0	0	0	0	0	0	0	0	0	0	0	0	0.0156	0	0	0.0738	0	3.39640562040671e-13	1.26628115283561e-13	12.8974698570605		0	
C2058948	Perfluoroundecanoic acid	0.00337	0.00933	0	0	0	0	0	0	0.000669	0	0	0.0511	0	0	0	0	0	0	0	0	0	0	0	0	0.0525	0	0.00127655593121783	1.65014424395065e-05	4.78247809117169		0.00751	
C205992	Benzo(b)fluoranthene	0.012	0	0	0	0	0.000457	0.0434	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.124	0	0	0	0	3.40127433321143e-18	5.81479824786666e-20	19.2354653490969	EAS hi AUC med	0.0112	
C206440	Fluoranthene	0.00745	0	0	0.0297	0	0	9.89e-07	0	0	0	0	0	0	0	0.0112	1.11e-05	0.00508	0.00108	0	0	0	0	0	0.0498	0	0	1.70380146737664e-17	1.07812585513914e-19	18.9673305387763	EAS hi AUC med	0.012	
C207736058	CI-1029	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.95876502863648e-11	2.34819582420198e-09	8.62926568858961		NA	
C20780487	3,7-Dimethyloctan-3-yl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00750939883131995	0.000830339198692716	3.08074445939807		0.00943	
C2078548	Propofol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.16942744839437e-18	4.11625012656876e-25	24.3854982429261	EAS hi AUC low	0.00783	
C20830755	Digoxin	0	0.000148	0	0	0	0	0	0	0.00184	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.336	5.86597497210074e-08	2.76668922209963e-09	8.55803962174354		NA	
C208968	Acenaphthylene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.81801433865078e-15	5.0608636545805e-19	18.2957753629206	EAS hi AUC low	0.00745	
C2104645	EPN	0.0868	0	0	0	0.00499	0.0598	5.5e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00172	0.0133	0	0.00188	0	0	7.37708323988333e-05	1.2017732069514e-05	4.92017748263503		0	
C210631688	Topramezone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.30647078234331e-07	1.37816042494355e-05	4.86070022538012		NA	
C210826407	CP-456773	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.44876505057933e-07	3.94934977110819e-05	4.40347440160521		0	
C21087649	Metribuzin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99395683416737	0.674082016741179	0.171287258878491		NA	
C210880925	Clothianidin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999765	0.999999999998561	6.25125280193618e-13		0	
C2110181	2-(3-Phenylpropyl)pyridine	0.0171	0	0	0	0	0.00139	5e-06	0	0	0	0	0	0.00242	0	0	0	0	0	0	0	0.0156	0	0	0.0463	0	0	0.0285804546954472	0.00671149356523683	2.17318082186366		0	
C21145777	6-Acetyl-1,1,2,4,4,7-hexamethyltetralin	0.0388	0	0	0.0383	0	0.0421	0	0	0	0	0	0	0	0	0.015	0	0	0.00132	0	0	0.0228	5.51e-07	0	0	0	0	-1	-1	0		NA	
C2122705	Ethyl 1-naphthaleneacetate	0	0	0	2.57e-06	0	0	0	0	0	0	0	0	0	0	0.0591	0	0	0	0	0	0	0	0	0	0	0	4.87268374560336e-11	1.43995880197259e-10	9.84164993313525		0	
C21245023	2-Ethylhexyl 4-(dimethylamino)benzoate	0.0114	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0532	0	0	0.00352	0	0	0.0053375634295005	0.0412556596244683	1.38451646468804		NA	
C2144538	Tridecafluorohexylethyl methacrylate	0.0134	0	0	0	0	0.0798	0	0	0	0	0	0	0	0	0	0	0	0	0.00121	0	0.0243	0	0	0	0	0	0.224286454979375	0.0503599432899049	1.29791476762087		NA	
C214535770	CP-457677	0	0	0	0	0	0	0	0	0.000355	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0746	2.51486199806275e-08	1.09261575919051e-06	5.96153253979057		0	
C215297271	UK-343664	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.437237703152108	0.0576559843122848	1.23915560911653		NA	
C2155706	Tributyltin methacrylate	0	0.132	0	0	0	0	0	0	0.12	0	0	0	0	0	0	0	0	0	0	0	0	0	1.56e-05	0	0	0.0271	0.941829078310317	0.781563642104632	0.107035651951256		NA	
C21564170	2-(Thiocyanomethylthio)benzothiazole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999877655653071	0.890159945727273	0.0505319514385591		0	
C2164172	Fluometuron	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.979732440800175	0.763453343439365	0.117217498628474		0	
C21662099	(4Z)-4-Decenal	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.313691199778234	0.0853640638160981	1.0687249181982		0.0879	
C21725462	Cyanazine	0	0	0	0	0	0.000257	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0826	0	0	0	0	0.999999011636559	0.999999723413361	1.20120067809913e-07		0.057	
C2176627	Pentachloropyridine	0	0	0	0	6.38e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0617	0	0	0	0	0	0	0.971320272817247	0.503894848335842	0.2976600817132		0	
C219714962	Penoxsulam	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0680803877276021	0.0127752550649421	1.89363042018025		NA	
C219790724	SB281832	0	4.35e-07	0	0	0	0	0	0	0.000687	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.231	0	0.000151212359340109	0.00017822702775513	3.74902643545714		NA	
C22047490	2-Ethylhexyl octadecanoate	0	0	0	0	0	0.0491	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0322	0	0	0	0	0.104781161102269	0.0102873606248515	1.98769603564533		0	
C220860504	CP-457920	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00337813348262695	0.00218575594224611	2.66039833225505		NA	
C221246124	Fandosentan potassium salt	0	0	0	0	0	0	0	0	0.000348	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.082	0	5.41660730074623e-06	0.00019333822471757	3.71368227353098		NA	
C2212671	Molinate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999997	0.999999999959622	1.75359092486389e-11		0.00391	
C221671621	SR146131	0	0.00907	0	0	0	0	0	0	0.000774	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.112	0	0.00206999153478353	0.00127066391545068	2.89596930307805		NA	
C22224926	Fenamiphos	0	0	0	0	0	0.000273	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0796	0	0	0	0	1.4303037416894e-11	6.59754322009766e-12	11.1806177560623		NA	
C22248799	Z-Tetrachlorvinphos	0	0	0	0	0	0.0211	0	0	0.00129	0	0	0	0	0	0	0	0	0	0	0	0.00517	0.00424	0	0	0.129	0	1.85495651839414e-14	3.08585272694007e-14	13.5106248045864		NA	
C22260511	Bromocriptine mesylate	0	0.0351	0.000331	0	0	0	0	0	0	0	0	0.131	0	0	0	0	0	0	0	0	0	0	0	0	0.0932	0	0.938444918719221	0.438558016671233	0.357972945847552		NA	
C2231574	Thiocarbazide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0299	0	0	0	0	0.999999999999999	0.999999999999931	2.98941514631529e-14		0	
C2243621	1,5-Naphthalenediamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0.135	0	0	0	0	0	0	0	0	0	0	0	0	0.00136978490188126	3.382590237499e-05	4.47075060888403		0.0386	
C2244215	Potassium dichloroisocyanurate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999154	3.67312332010302e-13		NA	
C22781233	Bendiocarb	0	0	0	0	0	0.000721	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.117	0	0	0	0	7.13619305931262e-08	4.38073498400865e-08	7.35845301901173		0	
C22839470	Aspartame	0.00559	0	0	0	0	0	4.92e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0152	0	0.0166	0	0	0.0675590601668131	0.0941756756949588	1.02606125512215		NA	
C22915737	Hexane-1,6-diyl dibenzoate	0.00322	0	0	0	0	0	3.71e-06	0	0	0	0	0	0	0	0.0015	0	0	0	0	0	0	0	0	0.0758	0	0	5.55868849912222e-07	1.98173718610567e-08	7.70295394126959		0.00552	
C23031369	Prallethrin	0	0	0	0	0	0	0	0	0.0433	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0402	2.68238795655928e-05	3.16929867072766e-06	5.49903683151439		0	
C2303175	Tri-allate	0	0	0	0	0	1.94e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0464	0	0	0	0	1	1	0		NA	
C23089261	Levomenol	0	0	0	0	0	0.000861	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.137	0	0	0	0	0	8.33561371666818e-10	2.59291575398794e-12	11.5862115935941		0	
C230954093	CP-544439	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.48559281967021e-05	3.60337408949778e-05	4.44329064862651		0	
C2310170	Phosalone	0.000105	0	0	0	0	0.0665	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0225	0	0	0	0	0	0.298058112595945	0.0781085907583126	1.10730119770079		0	
C23103982	Pirimicarb	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.996622598401991	0.88342512285107	0.0538302544318859		NA	
C2312358	Propargite	0	0.000113	0	0	0	0	0	0.194	0.064	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00181	0	3.03978614435765e-17	1.04515131335033e-19	18.9808208293655	EAS hi AUC low	NA	
C23135220	Oxamyl	0	0	0	0	0	0.000217	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.144	0	0	0	0	1	1	4.82163733276644e-17		0	
C23184669	Butachlor	0	0.00908	0	0	0	0	0	0	1.51e-06	0	0	0	0	0	0	0	0	0	0	0.000365	0	0	0	0	0.0281	0	0.912693181780265	0.912326642377962	0.0398496423906336		0	
C2321075	Fluorescein	0.00451	0.0354	0	0	0	0.00113	0	0	1.26e-05	0	0.0503	0	0	0	0	0	0	0	0	0	0.000479	0.00144	0	0	0.0185	0	6.27661538040589e-15	2.66111339214118e-19	18.5749366194238	EAS hi AUC med	0.276	KNN hi AUC med
C23386529	Dicyclohexyl sodium sulfosuccinate	0	0	0	0	0	0.00299	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.295	0	0	0	0	0.82468761296444	0.506736819770203	0.295217538491909		0	
C23422539	Formetanate hydrochloride	0	0	0	0	0	7.94e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0203	0	0	0	0	0.0550065627659339	0.0652385239357981	1.18549587371683		NA	
C2353459	FD&C Green No. 3	0	9.2e-05	0	0	0	0.00785	0	0	0.00177	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.17	3.23466348940107e-10	9.57682467425072e-10	9.01877846326418		0	
C23564058	Thiophanate-methyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999926497225	0.999698954546819	0.000130762062768454		0	
C23564069	Thiophanate	0	0	0	0	0	0	0.000884	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.167	0	0	0.999999966833999	0.999998386426282	7.00766727422383e-07		0	
C23593751	Clotrimazole	0.000434	0.00844	0	0	0	0.147	0	0	0.0341	0	0	0	0	0	0	0	0	0	0	0	0.00885	0.000232	0	0	0	0.00366	0.189830230214422	0.100642639287813	0.997217982658906		NA	
C23779320	1-[3-(Triethoxysilyl)propyl]urea	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999991464	0.99999999998936	4.62110543612126e-12		NA	
C2385855	Mirex	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.43667373708426e-09	1.02117481147517e-14	13.9908999061399		NA	
C2386870	UT-632	0.00355	0	0	4.02e-06	0	0	0	0	0	0	0	0	0.0365	0	0	0	0	0	0	0	0	0	0	0.0434	0	0	0.00240480308602106	0.00025072884444002	3.60079570090201		NA	
C2390605	Basic Blue 7	0	0.0669	0	0	0	0	0	0	0	0	0.00117	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0277	0.232401996586425	0.15515552815572	0.809232745991816		NA	
C2392394	Dexamethasone sodium phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.76349655595079e-07	6.57028579561769e-09	8.18241573900031		0.343	KNN hi AUC low
C23950585	Propyzamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0182297531287744	0.027335525400151	1.56327257437189		0	
C2396681	4-tert-Butylbenzenethiol	0.0234	0.000346	0.143	0	0	0	0	0	0	0.0243	0.00587	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.67062753520942e-14	7.79206550760226e-19	18.1083474050167	EAS hi AUC med	0	
C2409554	2-tert-Butyl-4-methylphenol	0	0.0164	0	0	0	0	0	0	0	0	0	0	0	0	0.0254	0	0.000651	0	0	0	0	0	0	0	0.0308	0	3.8991577105735e-19	1.14410919492915e-27	26.9415325240639	EAS hi AUC low	0.0193	
C24157811	2,6-Diisopropylnaphthalene	6.27e-05	0	0	0	0	0.000498	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.131	0	0	0	0	0	8.55039663935314e-16	2.84386540766842e-19	18.5460909614198	EAS hi AUC low	0	
C24169026	Econazole nitrate	0	0.0666	0	0	0	0	0	0	0.00754	0.0726	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0456	0.00802372720863555	0.0133924761787562	1.87313911743552		0	
C2416946	2,3,6-Trimethylphenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.01759211919793e-20	1.17366988141893e-25	24.9304540400892	EAS hi AUC low	0.00941	
C2425061	Captafol	0	0	0	0	0	0	0	0	0.0813	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0288	0	0.937732256693309	0.831990280136002	0.0798817473967244		0	
C2425776	2-Hexyl-1-decanol	0.0021	0.00695	0	0	0.00038	0	0	0	0	0	0	0	0	0.00173	0	0	0	0	0.151	0	0	0	0	0	0	0	8.57789125583765e-05	9.10919715649631e-07	6.04051989809486		0	
C2426086	Butyl glycidyl ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.992492977098751	0.639162446522872	0.1943887495686		0	
C24307264	Mepiquat chloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999868875	0.99999999994484	2.39558711411508e-11		NA	
C2432873	Dioctyl succinate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.401507916374633	0.0723659803965643	1.14046554980138		0	
C2433149	4-Cyclohexylcyclohexanol	0.0253	0	0	0.0239	0	0.00397	0	0	0	0	0	0	0	0	0	0	0.000316	1.47e-05	0	0	0.0242	0	0	0	0	0	9.58764901220712e-12	3.20008721118404e-15	14.4948381857989		0.248	KNN hi AUC med
C2440224	2-(2H-Benzotriazol-2-yl)-4-methylphenol	0.0875	0	1.96e-05	0	0	0.00846	1.29e-07	0	0	0	0	0.0322	0	0	0	0	0	0	0	0	0	0	0	0.0158	0	0	7.8286359717407e-11	2.31503904300572e-10	9.63544168023179		0	
C2445774	2-Methylbutyl isovalerate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.965071265425887	0.686578790583064	0.163309616690943		0	
C2451629	Triglycidyl isocyanurate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999969297	0.999999998852434	4.98381455380486e-10		NA	
C24549062	2-Ethyl-6-methylaniline	0.00519	0	0	0.00762	0	0	3.8e-06	0	0	0	0	0	0	0.0118	0	0.00132	0	0	0	0	0	0	0	0.012	0	0	0.00184343146995241	6.71947458477112e-05	4.17266468436516		0.139	KNN hi AUC med
C2457014	Barium bis(2-ethylhexanoate)	0.011	0.032	0	3.78e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0148	0	0.05	0	0	0	0	0	0	0.0393260975301722	0.00525524495603464	2.27940703594882		0.00456	
C24602866	Tridemorph	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999875441103398	0.998527349442982	0.000640035400684749		0	
C2465272	Auramine hydrochloride	0	0.000345	0	0	0	0	0	0	0.183	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.39e-07	0.034	0.178110073374022	0.0744603068303414	1.12807517850643		0.0518	
C2467029	Bisphenol F	0.0303	0	0	0.0452	0	0	0	0	0	0	0	0	0	0	0.00169	0	0	0.00486	0	0	0.0295	0	0	0	0	0	1.7703871939498e-18	2.63366994869831e-24	23.579438651713	EAS hi AUC med	0.00543	
C24800440	Tripropylene glycol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.973218684391405	0.359356645434888	0.444474319503445		0	
C24851987	Methyl dihydrojasmonate	0	0	0	0	0	0	0.000424	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.062	0	0	0.00066158061828012	0.000121401604334117	3.91577557397863		NA	
C2491385	2-Bromo-4-hydroxyacetophenone	0.0164	0	5.34e-06	0	0	0.0215	0	0	0	0	0.0835	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.47968948940634e-19	1.41604644432478e-24	23.8489225021666	EAS hi AUC med	0	
C2492264	Sodium 2-mercaptobenzothiolate	0	0	0	0	0	8.3e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0737	0	0	0	0	0.998960126507158	0.648015801223499	0.18841440415949		0	
C249296433	CJ-013610	4.43e-05	0.0638	0	0	0	0	0	0.13	0.122	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00709	0.00118	0.575981786942542	0.307033165071002	0.512814710420574		NA	
C25057890	Bentazone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.878256269543396	0.407268162163909	0.390119539182287		NA	
C25155184	Methylbenzethonium chloride	0.00822	0.152	7.09e-06	0.00843	0	0	0	0	0	0	0.0421	0	0	0	0	0	0.000629	0	0	0	0	0	0	0	0	0	7.1486387226728e-13	1.83959668096162e-13	12.7352773826604		NA	
C25155300	Sodium dodecylbenzenesulfonate	0	0.0185	0	0	0	0	0	0	0	0	0	0.00222	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.86916096149705e-10	2.08543539429492e-12	11.6808032598272		0	
C25168052	Chlorotoluene	0	0	0	0	0.000874	0	0	0	0	0	0	0	0	0	0	0	0	0	0.139	0	0	0	0	0	0	0	1.19447815990807e-07	1.32785061395568e-10	9.87685078128127		0	
C25265718	Dipropylene glycol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.965560061184031	0.279719559876003	0.553277163770757		0	
C2528167	Monobenzyl phthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.57022562580677e-11	3.1741089835878e-14	13.4983781657481		0.014	
C25322694	Polypropylene glycol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.954968523626952	0.0789621843351367	1.10258084626072		0.0156	
C253450098	Besonprodil	0	0	0	0	0	0	0.00071	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.132	0	0	0.0100807095673032	0.005008936150116	2.30025450431149		NA	
C25360105	tert-Nonanethiol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00166368977674658	6.64021870389128e-05	4.17781761636557		0	
C25496724	Glyceryl monooleate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0735512774820969	0.00745745198625708	2.12740953410009		0	
C25498491	Tripropylene glycol monomethyl ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998427012006242	0.477011710383337	0.321470959130877		0.0156	
C2550405	Dicyclohexyl disulfide	0.00737	0	0	0.00184	0	0.0597	0	0	0	0	0	0	0	0	0.0033	0	0.0156	0	0	0	0.00107	0.0118	0	0	0	0	0.430283112391022	0.0478534040054346	1.32008716367198		NA	
C2554065	1,3,5,7-Tetramethyl-1,3,5,7-tetravinylcyclotetrasiloxane	0.0268	0	0	0	0	0.0581	0	0	0	0	0	0	0.000384	0	4.72e-05	0	0	0	0	0	0.0056	0.00356	0	0	0	0	0.999998815723704	0.997547207793379	0.00106654265971976		0	
C25550985	Diisodecylphenyl phosphite	0	2.1e-07	0	0	0	0	0	0	0.000723	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.187	0	7.65154461339035e-15	1.20648984442036e-16	15.9184763293961	EAS hi AUC low	0.0117	
C25606411	Propamocarb hydrochloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999880472	0.999999998900624	4.77452849215861e-10		NA	
C25638179	Butylnaphthalenesulfonic acid sodium salt	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.9747361683879e-14	1.61286161739799e-15	14.7924028932301		0	
C25812300	Gemfibrozil	0	0	0	0	0	0.0564	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0302	0	0	0	0	0	6.37371521258091e-16	1.45875753535389e-17	16.8360168875504	EAS hi AUC low	NA	
C2593159	Etridiazole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999098444	0.999999998785606	5.27404674526496e-10		NA	
C25956176	Allura Red C.I.16035	0	0.0157	0	0.00423	0	0	0	0	2.2e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0946	2.02536513586918e-10	2.16300101121091e-11	10.6649432775266		0	
C26002802	Phenothrin	0	0	0	0	0	0.0834	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00961	0	0	0	0	8.64375011913703e-15	1.23047471645438e-14	13.9099273056647		0.0138	
C26027383	Polyoxyethylene(10)nonylphenyl ether	0.0406	0.0575	0	0	0	0	0	0.105	0.000527	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.6e-05	0.000114	2.55458533984609e-14	2.78076133389723e-17	16.5558362839943	EAS hi AUC med	0.41	KNN hi AUC med
C26040517	Bis(2-ethylhexyl) tetrabromophthalate	0.000358	0	0	0	0	0	0	0.377	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.64446579130918e-08	3.49121937098593e-09	8.4570228614077		0.115	KNN hi AUC med
C2610119	C.I. Direct Red 81 disodium salt	0	8.5e-05	0	0	0	0	0	0	0.00134	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.216	3.24681287385747e-08	7.62023411212872e-07	6.1180316858725		0	
C26172554	5-Chloro-2-methyl-3(2H)-isothiazolone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999989436076237	0.996377619461447	0.0015760361069849		NA	
C261947380	CP-532623	0	0	0	0	0	3.7e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0299	0	0	0	0	0	0.985438710317708	0.76515889754983	0.116248367247378		NA	
C26225796	Ethofumesate	0.00195	0.0129	0	0	0.000585	5.28e-06	0	0	0	0	0	0	0	0	0	0	0	0	0.000229	0	0.0434	0	0	0	0	0.00025	2.71356521796669e-16	7.11668691462595e-17	16.147722139729	EAS hi AUC med	NA	
C262376750	HMR1426	0.0176	0	0	0	0	2.84e-05	4.25e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0732	0	0.123	0.0286	0	-1	-1	0		NA	
C26264062	Calcium dodecylbenzene sulfonate	0	0.0477	0.0086	0	0	0	0	0	0	0	0.0234	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.04811911300913e-11	6.34550561263652e-13	12.1975337674181		0	
C2627954	1,3-Divinyl-1,1,3,3-tetramethyl disiloxane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999879841255	0.999609697820891	0.00016953917056821		0	
C2634335	1,2-Benzisothiazolin-3-one	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.33133657920575e-05	0.0004587067959682	3.33846482553267		NA	
C263553339	GW473178E methyl benzene sulphonic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0621229386578546	0.0214379499330825	1.66881674767884		NA	
C26402266	Glyceryl monooctanoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.213493076411184	0.0320353142403004	1.49437101157663		0	
C26447109	Ammonium xylene sulfonate	0	2.31e-07	0	0.000264	0	0	0	0	0	0	0	0	0	0	0	0	0	0.131	0	0	0	0	0	0	0	0	8.87477877422764e-09	9.38376179108084e-10	9.02762302541642		0.0123	
C264618442	SSR146977	0	0	0	0.000574	0	0	0	0	0	0	0	0	0	0	0	0.0908	0	0	0	0	0	0	0	0	0	0	0.227413175735284	0.0236710865293553	1.62578180701078		NA	
C26530201	Octhilinone	0	0	0	0	0	0.000171	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0946	0	0	0	0.021	0	0.972642439441831	0.98298206001181	0.00745440821971904		0.00534	
C26628228	Sodium azide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999989	0.999999999998338	7.2170267596908e-13		NA	
C26644462	Triforine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999951383	0.999999999997228	1.20386640924679e-12		NA	
C2675776	Chloroneb	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.05644245000007e-11	1.13750997067516e-13	12.9440447879102		0	
C2687254	2,3-Diaminotoluene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0361	0	0	0	0	0	0.0375155864240294	0.003671296038849	2.43518059428795		0	
C2687947	N-Octyl-2-pyrrolidone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999959871082763	0.998271694457035	0.000751242936178927		0	
C2687969	1-Dodecyl-2-pyrrolidinone	0	7.85e-05	0	0	0	0	0	0	0.0023	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0925	0	0.999959871082763	0.998271694457035	0.000751242936178927		0	
C26896208	Neodecanoic acid	0	0	0	0	0	1.51e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0387	0	0	0	0	4.30106664713943e-05	4.49873731952166e-06	5.3469093644723		0	
C2694544	Triprop-2-en-1-yl benzene-1,2,4-tricarboxylate	0	0	0	0	0	8.63e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0744	0	0	0	0	7.29089728330197e-10	2.45005531797003e-12	11.6108241099139		0.115	KNN hi AUC low
C2696846	4-Propylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000656224878676501	6.11062215915345e-05	4.21391456937588		0.0138	
C2702729	2,4-D sodium salt	0	0	0	0	0	0	0.000432	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0654	0	0	1.2960319329395e-07	1.448542200302e-08	7.83906884799814		0	
C27090637	N,N,N',N'-Tetrabutyl-1,6-hexanediamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999997635255689	0.999997706597461	9.96013209643959e-07		0.00331	
C27138314	Di(propylene glycol) dibenzoate	0.00955	0	0	0.00231	0	0	5.36e-06	0	0	0	0	0	6.83e-05	0	0.00489	0	0	0	0	0	0	0	0	0.107	0	0	1.52048647226772e-07	7.50127310730387e-08	7.12486502240094		0.0732	
C27176870	Dodecylbenzenesulfonic acid	0.000491	0.0328	0.00345	0	0	2.73e-05	0	0	0	0.000427	0	0	0	0	0	0	0	0	0	0	0	0.0871	0	0	7.44e-05	0	1.00002099589221e-12	1.05452689483933e-15	14.9769423394604		0	
C27178161	Diisodecyl hexanedioate	0	0	0	0	0	0	0.000417	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0895	0	0	0.179634862310061	0.016642985968561	1.77876875296526		0	
C271896	2,3-Benzofuran	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.70499254274972e-16	4.10119349621399e-19	18.3870897400138	EAS hi AUC low	0.0423	
C27193868	Dodecylphenol	0.392	0	0	0	0	0.00395	2.01e-05	0.0377	0	0	0	0	0	0	0	0	0	2.21e-06	0	0	0.00922	0	0	0.00286	0	0	5.79813736119388e-17	1.07167799042738e-23	22.9699356885131		0.41	
C27253334	Calcium neodecanoate	0.000105	0	0	0	0	0.0853	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00535	0.00139	0	0	0	0	0.000647418994024422	8.88904557637547e-05	4.05114486705739		0.011	
C27306781	Silwet L77	0.000232	0.0464	0	0	0	0	0	0.0999	0.00653	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0308	0	0.999998236110482	0.984165071313829	0.00693205243427495		NA	
C27314132	Norflurazon	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.729870653914444	0.177417852275865	0.751002682391479		0	
C27323417	Dodecylbenzene sulfonate triethanolamine (1:1)	0.0075	0	0	0	0	9.15e-06	8.91e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0123	0	0.102	0	0	2.14106059777005e-05	1.99051816972e-05	4.70103385376282		NA	
C27344418	Disodium 4,4'-bis(2-sulfostyryl)biphenyl	0.00215	0	0	0	0	0	0.000607	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0762	0	0	0	1.53584637847936e-10	1.89531815222397e-11	10.722317877961		0.0123	
C2756561	Isobornyl propanoate	0	0	0	0	0	0.000553	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0877	0	0	0	0	0	1.12334282473181e-05	9.25692376233805e-07	6.03353331299452		0.392	KNN hi AUC low
C2761242	Triethoxypentylsilane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.995953075514395	0.833872341229496	0.0789004310687255		0	
C2772454	2,4-Bis(1-methyl-1-phenylethyl)phenol	0.0274	0	0	0.00171	0	0.115	0	0	0	0	0	0	0	0	0	0	0	0.00366	0	0	0.00841	0.00326	0	0	0	0.0137	9.18328079709296e-19	6.12132564212289e-28	27.2131545162997	EAS hi AUC med	0.376	KNN hi AUC med
C2782572	Troclosene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999936143144456	0.991367409856847	0.0037653621627393		0	
C2783940	FD&C Yellow 6	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.6439631905899e-11	1.58361596529916e-13	12.8003501285374		0	
C2795393	PFOS-K	0	0	0	0	0	0.0867	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000311	0.0069	0	0	0	0	0.99124726331596	0.355122982332235	0.449621220750785		0	
C27955948	4,4',4-Ethane-1,1,1-triyltriphenol	0.319	5.19e-07	0.0202	0	0	0	0	0	0	9.82e-07	0.00119	0.0236	0	0	0	0	0.000876	0	0	0	0.00178	0.00846	0	0.000496	0.000471	0	9.27874329233882e-18	8.09012880870352e-28	27.0920445636209		0.552	
C2807309	2-Propoxyethanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.995415754110448	0.442461530974952	0.354124482280408		0	
C28159980	Cybutryne	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999961423436	0.999998898847455	4.78224737341886e-07		0	
C28249776	Thiobencarb	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0788	0	0	0	0	0	0.622745791164192	0.393097217909693	0.405500029827187		NA	
C283594901	Spiromesifen	0	0	0	0	0	3.97e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0522	0	0	0	0	1.37869257034441e-10	9.08349805099501e-11	10.0417468726586		0	
C2835952	5-Amino-2-methylphenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.8396367123503e-13	1.55601912951835e-14	13.8079850681476		NA	
C28434006	S-Bioallethrin	0	1.3e-07	0	0	0	0	0	0	0.0812	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0206	3.40025751702039e-05	4.01029782115287e-06	5.39682337369393		0	
C28631665	C.I. Acid Blue 22	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.219996910131174	0.0278885394515351	1.55457422953991		NA	
C2870328	C.I. Direct Yellow 12	0	0.00029	0.0918	0	0	0	0	0	0	0	0.042	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.34889530161694e-06	6.69766534106392e-06	5.17407655643191		0	
C28804888	Dimethylnaphthalene	0	0	0	0	0	3.21e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0218	0	0	0	0	1.3416356233622e-15	1.63867332113368e-18	17.7855076168809	EAS hi AUC low	0	
C288104790	Surinabant	0.0866	0	0	0	0	5.33e-05	8.62e-07	0	0.0041	0	0	0	0	0	0	0	0	0	0	0	0	0.0168	0	0.0162	0.0176	0	0.979944338983671	0.452357155008145	0.344518535985108		NA	
C288324	Imidazole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999989210668	0.998957629847799	0.000452931707479846		NA	
C288880	1H-1,2,4-Triazole	0.000127	0	0	0	0	0.104	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0215	0	0	0	0	0.999999999908014	0.999885053064945	4.99236889485585e-05		0	
C2893789	Sodium dichloroisocyanurate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999447967903	0.999622515589531	0.000163970346543297		0	
C289716945	CP-607366	0	0.00686	0	0	2.29e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00936	0	0	0	0	0	0	0.0437	7.60909859901769e-10	6.7603620955811e-09	8.17003004194279		NA	
C290352282	CP-634384	0.00739	0	0	0	0	0.000178	1.83e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0136	0	0	0.0981	0	0	6.96654354880192e-11	2.75826456820877e-08	7.55936407934855		NA	
C29091212	Prodiamine	0.00775	0.0823	0	1.54e-05	0	0	0	0	0	0	0	0	0	0	0.00758	0	0	0	0.0379	0	0	0	0	0	0.00157	0	0.836470767056238	0.662480521753196	0.178826886326193		0.0398	
C29122687	Atenolol	0	0	0	0	0	1.63e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0177	0	0	0	0	6.18743537007631e-10	3.05617343656405e-09	8.51482200336682		NA	
C291305061	UK-373911	0	6.68e-08	0	0	0	0	0	0	0.0359	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0334	0	0.00443565998079229	0.00437522991292766	2.35899912040344		NA	
C2917739	Dibutyl nonanedioate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.424693286565557	0.0777268192053761	1.10942910445222		0.0173	
C2919666	Melengestrol acetate	0.155	0	0.0254	0	0	0	0	0.154	0	0	0.00303	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.96992975577346e-06	6.85410325233977e-08	7.16404935750994		0.392	
C2921882	Chlorpyrifos	0.0125	0	0	0.000347	0	0	0	0	0	0	0	0	0	0	0.0131	0	0.000153	0	0	0	0.00697	0.00631	0	0	0	0	0.356326011968662	0.195738422923263	0.708323915140919		0	
C29232937	Pirimiphos-methyl	0.0176	0	0	0.00098	0	0.055	0	0	0	0	0	0	0	0	0.00287	0	0.00067	0	0	0	0.00155	0.0305	0	0	0	0	0.999445857425995	0.977404471428981	0.00992567849334839		0.0237	
C2934056	2,4-Diisopropylphenol	0.00488	0	0	4.9e-06	0	0.104	0	0	0	0	0	0	0	0	0	0	0.00148	0	0	0	0.0303	0	0	0	0	0	1.06404793570229e-18	3.82267630333163e-26	25.4176324756218	EAS hi AUC med	0.0274	
C29385431	Tolyltriazole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.10760651277707	0.0226586382721981	1.64476619370653		0	
C29387868	Propylene glycol monobutyl ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.865921640333203	0.279142899241798	0.554173415133369		0	
C29420493	PFBS-K	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999999998104	0.999985173041906	6.43931382135758e-06		0	
C2943751	Triethoxyoctylsilane	0	0	0	0	0	1.12e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0609	0	0	0	0	0	0.739604756021777	0.276929858990707	0.557630215450592		0	
C29590429	Isooctyl acrylate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.098628275425665	0.0180163943891842	1.74433211976993		0	
C2971360	2,2-Bis(4-hydroxyphenyl)-1,1,1-trichloroethane	0.568	0.0413	0.000103	0.000399	0	0	0	0	0	0.000662	0	0.000826	7e-04	0	0	0.0205	0	0.000353	0.0534	0	0	0	0	0	0	0	1.98089999770617e-18	1.07903907069364e-26	25.9669628297569		0.552	
C298000	Methyl parathion	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.44566833633797e-05	8.99969470952025e-07	6.04577222258507		0.0868	
C298022	Phorate	0.0181	0	0	0	0	0.0101	7.29e-06	0	0	0	0	0	0	0	0.000721	0	0	0	0	0	0.0022	0.0122	0	0.0228	0	0	0.999999920663393	0.999766812340026	0.000101283923514371		0.0974	
C298044	Disulfoton	0.025	0	0	0	0	0.00683	3.22e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.014	0	0.0196	0	0	0.999998734023371	0.997865546091732	0.000927972263938863		0.0181	
C298077	Bis(2-ethylhexyl) phosphate	0	7.85e-05	0	0	0	0	0	0	0.00326	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.137	0	0.00551670165193174	0.000769923430620655	3.11355246354495		0.00568	
C298198524	SSR180711	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0298574311401458	0.0333753083311523	1.47657471346559		NA	
C29836268	Octyl beta-D-glucopyranoside	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00236674168278211	0.000208910084864929	3.68004059450761		0	
C298464	Carbamazepine	0	0	0	0	0	0.000867	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.11	0	0	0	0	0.925741599702333	0.701936239190221	0.15370233548483		NA	
C2996921	Trimethoxyphenylsilane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000202537218122409	1.59392940046124e-05	4.7975309186169		NA	
C300765	Naled	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999139811120458	0.999097689334535	0.000392045442977296		NA	
C3025307	Ethyl (2E,4Z)-deca-2,4-dienoate	0	0.0214	0	2.5e-06	0	0	0	0	3.01e-07	0	0	0	0	0	0	0	0	0.0258	0	0.0102	0	0	0	0	0.0221	0	0.514310996333923	0.296784386738558	0.527558950197751		NA	
C3026639	Sodium tridecyl sulfate	0	0.0186	0.0152	0	0	0	0	0	4.43e-07	0.00275	0	0.00564	0	0	0	0	0	0	0	0	0	0	0	0	0.00312	0	0.555499952708138	0.15311952375881	0.814969430332922		0.093	
C302794	trans-Retinoic acid	0.000228	0	0	0	0	0.241	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0818	0	0	0	0	8.20815214469802e-12	5.70364409143442e-13	12.2438475823758		0	
C3033770	N,N,N-Trimethyl(oxiran-2-yl)methanaminium chloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999722	1.20878447932471e-13		NA	
C30399849	Isooctadecanoic acid	0	0	0	0	0	0.00033	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0663	0	0	0	0	0	0.00156521335819853	6.18668416623823e-05	4.20854205439556		0.00457	
C30516871	3'-Azido-3'-deoxythymidine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99984777292252	0.989607663898538	0.00453695002408845		0.0289	
C30560191	Acephate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999999	4.82163733276644e-16		NA	
C3056175	Stavudine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.96317539751952	0.790785246811249	0.101941441644952		0	
C307244	PFHxA	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0494048391400286	0.00332240749349812	2.47854710237096		0.00751	
C309002	Aldrin	0.000104	0	0	0	0	0.225	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00306	0.0176	0	0	0	0	1.50479190733758e-10	1.18735056758577e-13	12.9254210358139		0.0191	
C311455	Paraoxon	0	0	0	0	0	0	0	0	0.00144	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.148	0	1.74754726938282e-05	2.96844823869824e-06	5.52747051953352		0.0868	
C31218834	Propetamphos	0	0	0	0	0	0.079	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0304	0	0	0	0	0.999987913952539	0.999970010749843	1.30243611561648e-05		NA	
C313994795	MK-578	0	0	0	0	0	0.00115	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.144	0	0	0	0	0.466175351221645	0.191762003546296	0.717237441403716		NA	
C314409	Bromacil	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998546844060666	0.953794475725	0.0205451972817878		0	
C3147759	Octrizole	0	0	0	0	0	0.028	0	0	0.000341	0	0	0	0	0	0	0	0	0	0	0	0.00823	0.0423	0	0	0	0.0316	1.95565545409143e-15	1.75237250692971e-16	15.7563735691108	EAS hi AUC low	0.0875	
C31519229	1,4-Dihydroxy-2-naphthoic acid	0	0.0324	0	0	0	4.76e-05	0	0	0.000147	0	0	0	0	0	0	0	0	0	0.00395	0	0	0.027	0	0	0	0.0806	3.15524518298407e-19	1.83645346284774e-22	21.7360200725376	EAS hi AUC low	0	
C3164850	Potassium 2-ethylhexanoate	0.00456	0	0	5.33e-06	0	1.69e-06	0	0	0	0	0	0	0	0	0	0	0	0.0259	0	0	0	0.0757	0	0	0	0	0.0508843484493841	0.00789053578616352	2.10289350616016		0.011	
C3194556	1,2,5,6,9,10-Hexabromocyclododecane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.011021647781398	0.000721751226324789	3.1416124695385		NA	
C319857	beta-Hexachlorocyclohexane	0.082	0	0	0	0	0	9.36e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0492	0	0	0.0135	0	0	0.00230922065142162	0.000100736415396988	3.99681350713133		0.00306	
C32388559	1-Cedr-8-en-9-ylethanone	0.0562	0	0	0	0	0.0634	0	0	0	0	0	0	0	0	2.35e-05	0	0	0.000347	0	0	0.00478	0.000442	0	0	0	0	1.00843840327804e-07	5.87639439958171e-11	10.2308890638324		0.183	KNN hi AUC med
C3268493	3-(Methylthio)propanal	0	0	0	1.84e-06	0	0	0	0	0	0	0	0	0	0	0	0.0613	0	0	0	0	0	0	0	0	0	0	0.999993173635629	0.995758443458459	0.00184600233578702		NA	
C32809168	Procymidone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.855088138525385	0.466249397863895	0.331381716050938		NA	
C328847	1,2-Dichloro-4-(trifluoromethyl)benzene	0	0	0	0.000833	0	0	0	0	0	0	0	0	0	0.106	0	0	0	0	0	0	0	0	0	0	0	0	6.52605926402081e-08	7.25043220661864e-10	9.13963610386283		0	
C3296900	2,2-Bis(bromomethyl)-1,3-propanediol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.187746671079964	0.000564717710561869	3.24816859179441		0	
C330198919	Fully acetylated glycerol monoester on 12-Hydroxystearic acid (85%); Fully acetylated glycerol monostearate represents (10%)	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.454755928753939	0.0847071095265103	1.07208013750217		0	
C330541	Diuron	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999987004084957	0.977263134409607	0.00998848394172904		0	
C330552	Linuron	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999998199130782	0.985832084304507	0.0061970516614567		0	
C33089611	Amitraz	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.194115278843922	0.197245864572578	0.704992093376524		NA	
C331623064	MK-547	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.78503825921234e-09	2.93252736907408e-08	7.53275792595331		NA	
C3319311	Tris(2-ethylhexyl) trimellitate	0.115	0	6.35e-07	3.05e-05	0	0.0291	0	0.000316	0	0	0	0.0331	0	0	0.000194	0	1.77e-05	5.85e-05	0	0	0.00152	0.00308	0	0.00172	0	0	8.52427691581315e-09	3.97199790724089e-10	9.40099098899689		0	KNN low AUC hi
C33228443	4-Pentylaniline	0.0138	0.00901	0	0.00473	0	0.0204	0	0	1.7e-05	0	0	0	0	0	0.000686	0	0	0	0	0	0.01	2.7e-07	0	0	0.0178	0	7.37010005784129e-05	6.37955144572757e-05	4.19520985599571		0.00955	
C33228454	4-Hexylaniline	0.00955	0.0357	0	0	0	0.0282	0	0	0.000329	0	0	0	0	0	0	0.00277	0	0	0	0	5.37e-08	0.00174	0	0	0.0268	0	5.73045513958582e-05	9.07296597675692e-05	4.04225071770582		0.0138	
C333415	Diazinon	0.0237	0	0	0.000771	0	0.135	0	0	0	0	0	0	0	0	0	0	0.00165	0	0	0	5.22e-05	0.0341	0	0	0	0	0.94687009844738	0.688226708463693	0.162268477438239		0.0176	
C3337711	Asulam	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999994624767933	0.993285276794861	0.00292600191288341		NA	
C334485	Decanoic acid	0.000102	0	0	0	0	0.122	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0135	9.34e-08	0	0	0.000912	0	0.0262525702019687	0.00094833143785581	3.02303985203383		0.248	KNN hi AUC med
C335671	PFOA	0	0	0	0	0	0.0726	0	0	0.000304	0	0	0	0	0	0	0	0	0	0	0	0.00222	0	0	0	0.0799	0	0.00101252529697505	1.54409892620298e-05	4.81132487904706		0.00751	
C335762	PFDA	1.42e-05	0	0	0	0	0.0294	0	0	0.000946	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.121	0	0.00127655593121783	1.65014424395065e-05	4.78247809117169		0.00751	
C33629479	Butralin	0.0426	0	0	0	4.38e-08	0	7.79e-06	0	0	0	0	0	0	0	0	0	0	0	0.00345	0	0.00418	0	0	0.0126	0	0	0.0640516627407585	0.0380313378947257	1.41985839638499		0.0656	
C33703081	Hexanedioic acid, diisononyl ester	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.179634862310061	0.016642985968561	1.77876875296526		0	
C3380345	Triclosan	0	0	0	0	0	0	0	0	0.0553	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00291	0	2.72180037760679e-13	7.95205755323455e-16	15.0995204853811	EAS hi AUC low	0.00424	
C33820530	Isopropalin	0.0122	0.0372	0	0.0175	0.0131	0	0	0	0	0	0	0	0.000869	0	0	0.0013	3.45e-06	0.0261	0.00516	0.00424	0	0	0	0	0	0	0.528192605141284	0.368813115228367	0.433193643556497		0.0426	
C3383968	Temephos	0.00268	0.0264	0.00024	0	0	0	0	0	0.0303	0	0.133	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.21766849015022e-10	9.40081192022757e-14	13.0268346360549		0.0115	
C3391864	1-Octen-3-ol	0	0	0	0.0206	0	0	0	0	0	0	0	0	0	0	0	0.0104	0	0.0309	0	0	0	0	0	0	0	0	0.000235452435992682	1.09506594006478e-05	4.96055972872884		0	
C33956499	Codlelure	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.86385753936398e-05	1.15840595617881e-06	5.93613921812816		0.00481	
C34014181	Tebuthiuron	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999994	0.999999994279381	2.48443340719846e-09		NA	
C34256821	Acetochlor	0	2.67e-07	0	0	0	0	0	0	0.00145	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.127	0	0.977844398547682	0.918243212664188	0.037042273125205		0	
C34451199	Butyl (2S)-2-hydroxypropanoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.893190115844214	0.449240758151364	0.347520848498677		0	
C344930956	SSR69071	0.000101	0	0	0	0	0.0016	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.157	0	0	0	0	0	0.0437639081221829	0.00638935256023792	2.19454314712511		NA	
C3452979	3,5,5-Trimethyl-1-hexanol	0	0	0	0.0174	0	0	0	0	0	0	0	0	0	0	0	0.0477	0	0.00785	0	0	0	0	0	0	0	0	5.06128748448777e-05	2.94815679551083e-06	5.53044942257204		0	
C34590948	Propanol, 1(or 2)-(2-methoxymethylethoxy)-	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.966526259946935	0.451747676085194	0.345104072892039		0	
C349495427	PharmaGSID_47263	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	-1	-1	0		NA	
C35256850	Butam	0.0822	0	0	0	0	0.0204	0	0.0181	0	0	0	0	0	0	0	0	7.13e-05	0.00013	0	0	0.0102	0.00237	0	6.83e-05	0	0	0.729693473402959	0.41102293903091	0.386133939640857		NA	
C353280076	CP-612372	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.92559317569078e-06	4.86849101468157e-05	4.31260562719364		0	
C35367385	Diflubenzuron	0	0	0	0	0	3.34e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0276	0	0	0	0	0.600821225424027	0.21727107048824	0.66299809587793		NA	
C35400432	Sulprofos	0.0115	0	0	0	0	0.101	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00468	0.00487	0	0	0	0	3.4364173267204e-10	1.83879529682959e-11	10.7354666157351		0.00268	
C3547339	2-Hydroxyethyl octyl sulfide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.211135050650164	0.0253153225096977	1.59661653545905		NA	
C35554440	Imazalil	8.32e-06	7.36e-06	0	0	0	0	0	0	0.00137	0	0	0	0	0	0	0	0	0	0	0	0	0.0247	0	0	0	0.0893	0.00691241200238884	0.00845572748337145	2.07284902219722		0	
C35575963	Azamethiphos	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.884450570411494	0.308481115480122	0.510771417348108		0	
C35691657	1,2-Dibromo-2,4-dicyanobutane	0	4.51e-05	0	0.0739	0	0	0	0	0	0	0	0	0	0	0	0.00141	0	0.00993	0	0	0	0	0	0	0	0	0.94072504344311	0.518415406973788	0.285322099991882		NA	
C361343193	Elzasonan	0	0.0129	0	0	1.25e-06	0	0	0	0.0128	0	0	0	0	0	0	0	0	0	0.00589	0	0	0	0	0	0.0126	0	0.998135422352269	0.861598371002285	0.0646951308166064		NA	
C361377299	Fluoxastrobin	0	1.6e-07	0	0	0	0	0	0	0.101	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.137	0.000667586713824219	0.00112708014645809	2.94804520025656		NA	
C3622842	N-Butylbenzenesulfonamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.81680521907467	0.703124584055675	0.152967717122148		0	
C3653483	MCPA-sodium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.47600361913392e-12	1.14263617136762e-11	10.9420920320025		0	
C36631308	Triisodecyl trimellitate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.05057401844431e-08	5.69025856998442e-10	9.24486799846152		0.115	KNN hi AUC low
C36653824	1-Hexadecanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0232132941280827	0.000330728057969953	3.48052895929064		0.00481	
C36734197	Iprodione	0	0	0	0	0	0.000211	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0727	0	0	0	0	0.999999998845857	0.995068867067742	0.00214686141254632		NA	
C3681718	(3Z)-3-Hexenyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.989995377491977	0.864864245442079	0.0630520567922074		0	
C368832422	CP-728663	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0403	0	0	0	0	0.04	1.75074881503904e-06	1.22350567382912e-05	4.9123940123302		NA	
C3691358	Chlorophacinone	0	0.0307	0	0	0	0	0	0	0.0469	0	0.000126	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0537	0	1.36926512025427e-20	3.19401725110581e-19	18.495662742537	EAS hi AUC low	NA	
C3734336	Denatonium benzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0594561011026117	0.0395298378958478	1.40307496661031		0	
C3734676	C.I. Acid Red 1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.66559015810974e-07	4.24913077552889e-06	5.37169990242036		0	
C3739386	3-Phenoxybenzoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.05083554979396e-14	2.17390887916841e-17	16.6627586636093	EAS hi AUC low	0.275	KNN hi AUC low
C375859	Perfluoroheptanoic acid	0	0	0	0	0	1.03e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0212	0	0	0	0	0.00428928410051539	0.000126446920331188	3.89809174361858		0.00751	
C375951	PFNA	0.00751	0.0209	0.000533	0	0	0.0481	0	0	0	0	0	0.125	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00127655593121783	1.65014424395065e-05	4.78247809117169		0.00337	
C37764253	Dichlormid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.99999999999998	8.53429807899667e-15		NA	
C3811049	Potassium chlorate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999998691695	5.68189458284612e-10		NA	
C3811732	Sodium (2-pyridylthio)-N-oxide	0	0.00872	0	0.0279	0	0	0	0	0	0	0	0	0	0.0235	0	0.0107	0	0.000314	0	0	0	0	0	0	0	0.0223	0.997360194017396	0.708172078348409	0.149861200506831		0	
C3825261	PFOA, ammonium salt	0	0	0	0	0	0.0178	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0159	0	0	0	0.0262	0	0.0823930209626416	0.0117795064615127	1.92887290526469		0.00751	
C3844459	FD&C Blue No. 1	0	0.000382	0	0	0	0	0	0	0.00292	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.205	0.906020121199663	0.555297859234054	0.255474000801933		0	
C3855321	2,6,10-Trimethyl-2,6,10-triazaundecane	0.00669	0	0	0	0	0	1.93e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00283	0	0	0.0422	0	0	0.999999999999029	0.999999999948339	2.2436283919275e-11		0	
C3871996	PFHS-K	0	0	0	0	0	1.36e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0372	0	0	0	0	0.999999822909241	0.989294765853366	0.00467428867556142		0	
C3913028	2-Butyloctan-1-ol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.54113366261329e-05	7.63021154252328e-07	6.11746342135351		0.0021	
C39236469	Imidazolidinyl urea	0.00189	0	0	0	0	0.0379	0	0	0	0	0	0	0	0	0	0.000484	0	0	0	0	0.0508	0	0	0	0	0	1	0.999999999876396	5.36805420547128e-11		0	
C3926623	Sodium chloroacetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999881669103	0.999880713569071	5.18085288069655e-05		NA	
C39300453	Dinocap	0	0.0465	0	0	0	0	0	0	0.086	0	0	0	0	0	0	0	0	0	0	0	0	0.000805	0	0	0.00219	0.0107	2.59810978071125e-10	4.58982907871076e-08	7.33820348691478		NA	
C39515418	Fenpropathrin	0.0117	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00541	0.00609	0	0.00487	0.00391	0	1.24268510449569e-15	4.30633596880836e-15	14.3658920906975		0.0138	
C39905572	4-Hexyloxyaniline	0.00257	0.00293	0	0	0	0	0.000403	0	0	0	0	0	0	0	2.12e-05	0	0	0	0	0	0	0	0	0.0627	7.67e-05	0	2.10513840323934e-06	1.25054174939654e-06	5.90290180474925		0.161	KNN hi AUC med
C402910274	UK-416244	0	0	0	0	0	0	0	0	0.0646	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00424	0	2.16901435010139e-07	9.10061235001286e-07	6.04092938446086		NA	
C40487421	Pendimethalin	0.0656	0.000214	0	0.00471	0	0	0	0	0	0	0	0	0	0	0.00013	2.53e-05	0.00853	0.00032	0.00487	0	0.0018	0.000179	0	0	0	0	0.467426100601949	0.20965026958301	0.678504574813771		0.0426	
C40649363	4-Propylcyclohexanone	5.9e-05	0	0	0	0	0.174	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0123	0	0	0	0	8.16577755329297e-06	6.61764368274255e-07	6.17929662049208		0.0491	
C4065456	Sulisobenzone	0	0	0	0	0	5.05e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0314	0	0	0	0	4.92926858065618e-14	1.28083943300688e-17	16.8925053103254	EAS hi AUC low	0.0645	
C4098719	Isophorone diisocyanate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0324572560269324	0.0254323595746221	1.5946133447909		NA	
C4107986	N,N-Diisopropylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.994300810672432	0.941824428109987	0.0260300494467186		0	
C41198087	Profenofos	0.0025	0.00658	0	0	0	0.0436	0	0	0	0	0	0	0	0	2.92e-05	0	0	0	0	0	0.0172	0.00436	0	0	0.00558	0	1.58732122628942e-11	2.39661203387436e-12	11.6204022643329		NA	
C4130421	2,6-Di-tert-butyl-4-ethylphenol	0	0	0	0	0	0.000346	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0962	0	0	0	0	0	8.38726068000669e-19	1.54809013599006e-27	26.8102037565579	EAS hi AUC low	0.0193	
C41372081	Methyldopa sesquihydrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.75796151618051e-18	1.03718744086061e-20	19.9841427506743	EAS hi AUC low	NA	
C41372207	Apomorphine hydrochloride hydrate	0.00617	0.0435	0.071	0	0	0	0	0	0	0	0	0.00323	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.57446312143648e-17	9.63717997428165e-17	16.0160500304934	EAS hi AUC med	NA	
C41481667	4,4'-Sulfonylbis[2-(prop-2-en-1-yl)phenol]	0.0231	0.0449	0.0114	0	0	0.0361	0	0	0	0	0	0.00786	0	0	0	0	0	0	0	0	0.00939	0.00227	0	0	0	0	1.69101162315059e-17	7.70656164992407e-22	21.1131393430295	EAS hi AUC med	NA	
C4151502	Sulfluramid	0	0	0	0	0	0.0332	0	0	0.00104	0	0	0	0	0	0	0	0	0	0	0	0.0354	0	0	0	0.104	0	0.999999698680985	0.99999347385664	2.83427729774407e-06		0.024	
C4180238	(E)-Anethole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.21650707727396e-16	2.46737631974553e-20	19.6077646076546	EAS hi AUC low	0.0124	
C420042	Cyanamide	0	0	0	0.00017	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0846	0	0	0	0	0	0	0	0	0.999999999994927	0.999999999980567	8.43964933823639e-12		NA	
C42509808	Isazofos	6.95e-05	0	0	0	0	0.0781	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0118	0.00497	0	0	0	0	0.999999999984651	0.999999999999303	3.02654175377855e-13		NA	
C427510	Cyproterone acetate	0.000543	0	0	0	0	0	0	0.781	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.9095594073883e-06	5.84090236376511e-08	7.2335200533447		0.392	KNN hi AUC med
C42874033	Oxyfluorfen	0	0	0	0	0	0.0965	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00408	0.000221	0	0	0	0	3.80666414137955e-08	5.98016782970589e-08	7.22328662763494		NA	
C4291638	Cladribine	0.0207	0	0	0	0	1.62e-05	5.28e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0242	0	0.0814	0	0	0.999999492721155	0.999243731591436	0.000328567454936282		0.0289	
C43121433	Triadimefon	0.0039	0	0	0	0	0.124	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0206	0	0	0	0	0	1.77988923646652e-08	7.79619657017513e-07	6.10811721928939		0.0188	
C43222486	Difenzoquat metilsulfate	0.000101	0	0	0	0	0	0	0.201	1.7e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0309	0.777769314559461	0.325324416784536	0.487683340109347		NA	
C4342363	Tributyltin benzoate	0	0.18	1.49e-05	0	0	0.000316	0	0	0.0481	0	0.00931	0	0	0	0	0	0	0	0	0	0	0	0	0	1.19e-07	0.00506	3.87877451368058e-12	2.21318818221181e-13	12.6549816574593		0	
C4344552	4-Butyloxyaniline	0.00848	0	0	1.03e-05	0	0	3.55e-07	0	0	0	0	0	0	0	0	0	0	0.0261	0	0	0.00395	0	0	0.027	0	0	1.46060566707539e-06	3.30238468539841e-07	6.48117233839762		0.00457	
C4376185	Monomethyl phthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.12198408335928e-13	3.84913679324131e-16	15.4146366543785	EAS hi AUC low	0	
C4376209	Mono(2-ethylhexyl) phthalate	0	0	0	0	0	2.63e-05	0	0	8.54e-05	0	0	0	0	0	0	0	0	0	0	0	0	0.0114	0	0	0.0654	0	6.9458522626984e-09	1.33020295788512e-10	9.87608209078862		0	
C439687691	Nelivaptan	0	0	0	0	0	8.88e-05	0	0	0.000385	0	0	0	0	0	0	0	0	0	0	0	0	0.0558	0	0	0.067	0	0.0074877128126498	0.00159480445634428	2.79729255946373		NA	
C4418262	Sodium dehydroacetate	0	0	0	0	0	0	0.000501	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0941	0	0	0.0201938238658322	0.0091790778667837	2.03720094597553		0	
C4437858	Butylene carbonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998400379406146	0.926555879828617	0.0331283836096247		0	
C444610917	PharmaGSID_47315	0	0.000279	0	0	0	0.00135	0	0	0.000818	0	0	0	0	0	0	0	0	0	0	0	0	0.181	0	0	0.141	0	0.0337347779163217	0.0103270843056132	1.98602227758225		NA	
C4449518	Cyclopamine	0	0	0	6.43e-06	0	0	0	0	0	0	0	0	0	0	0	0.0639	0	0	0	0	0	0	0	0	0	0	1.05117329430196e-06	4.11225111478394e-07	6.38592037299257		NA	
C445295045	CP-671305	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000632576059845973	0.000370328087457987	3.43141334772529		NA	
C4455269	N-Methyldioctylamine	0.000107	0	0	0	0	0.103	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0662	0	0	0	0	0	0.999182156014232	0.999206169591884	0.000344893077236777		0.00331	
C446720	Genistein	0.538	0	0.022	0	0	0.0284	0	0	0	0	0.0403	1.88e-05	0	0	0	0	0.000183	0	0	0	3.54e-07	0.00937	0	0.00286	0	0	2.21763345771276e-13	3.59993857332744e-22	21.4437049096473		0.44	
C4468422	3-Phenylhexane	0	0	0	0	0	0.0859	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000107	0.00868	0	0	0	0	4.46876326577623e-14	1.32571759281299e-16	15.877548980415	EAS hi AUC low	0	
C446866	Azathioprine	0	0	0	0	0	0.0753	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00431	0.0137	0	0	0	0	0.999999999680988	0.999851489731759	6.45019797247185e-05		NA	
C451401	1,2-Diphenylethanone	0.0227	0	0	0	0	0.0109	0	0	0	0	0	0	0	0	0.000398	0	0.000169	0	0	0	0.0261	3.34e-07	0	0.00169	0	0	3.20870170792896e-18	1.50377686293446e-18	17.8228166015008	EAS hi AUC med	0.0491	
C4548532	FD&C Red 4	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.01616162580028e-11	4.18164528981066e-12	11.3786528092064		0	
C4553622	2-Methylpentanedinitrile	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.895026754420556	0.449919452173013	0.346865229797814		NA	
C4574043	Myristyltrimethylammonium chlorideN,N,N-Trimethyltetradecan-1-aminium chloride	0.0071	0.0166	0	0	0	0	0	0.255	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0011	0	0.998985438779918	0.998993886123072	0.000437169663044767		0.00313	
C460004	1-Bromo-4-fluorobenzene	0	0	0	0	0	0.0731	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.92e-07	0.0199	0	0	0	0	7.38440340296328e-08	1.43985545483426e-10	9.84168110395942		NA	
C4602840	Farnesol	0.0162	0	0	4.35e-06	0	0.071	0	0	0	0	0	0	0	0	0	0	0	0.0292	0	0	0.00403	0	0	3.44e-05	0	0	0.00838095188050826	0.000413603510485627	3.38341578379693		0	
C461023632	Aplaviroc hydrochloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.07181185193209e-06	1.95889580981658e-06	5.7079886627419		NA	
C461585	Cyanoguanidine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999987	0.99999999999999	4.43590634614514e-15		NA	
C463401	Linolenic acid	0.00166	0.00511	0	0	4.31e-07	0	0	0	0	0	0	0	0	0	0	0	0	0.0112	0.0309	0	0	0	0	0	0	0	0.00378349737636038	0.000110456617512004	3.95680826021033		0	
C4638486	5-Chlorosalicylanilide	0	0.0122	0	0	0	0	0	0	9.46e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0273	1.69098079154018e-09	9.69747705951886e-08	7.01334123909951		0	
C464493	D-Camphor	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.77230022473001e-07	9.00971448944665e-10	9.04528897124319		0.183	KNN hi AUC low
C4707475	Methyl 2,4-dihydroxy-3,6-dimethylbenzoate	0.00793	0	0	0.000224	0	0.0181	0	0	0	0	0	0	0	0	0.00192	0	0.0024	0	0	0	0.0519	0	0	0	0	0	1.39813428327413e-15	8.77750275763252e-20	19.0566290254201	EAS hi AUC med	0	
C470826	1,8-Cineol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.74147335785282e-09	2.72141222308727e-11	10.5652056689323		0	
C4712554	Diphenyl phosphite	0.142	0	6.57e-06	0	0	0	0	0.0207	0	0	0.027	0	0	0	0	0	0	0	0	0	0	0.0024	0	0.00347	0	0	2.04150326893567e-13	5.43182172411357e-17	16.2650544923182		0.0641	
C473289622	Ilepatril	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0430669772487142	0.0209149851950637	1.67954243850407		NA	
C474862	Equilin	0.822	0	0	0	0	0	0.00268	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.9662950578492e-18	3.08869672055097e-26	25.510224733025		0.807	
C478149530	PHA-00543613	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.259354562769256	0.0349949287321702	1.45599488659854		NA	
C478263988	AVE3295	0	0.00013	0	0	0	0	0	0	0.000168	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0657	0	0.991557948947182	0.381981449566694	0.417957727524003		NA	
C480400	Chrysin	0.134	0	0	0	0	0.0345	0	0	0	0	0	0	0	0	0	0.000438	0	0	0	0	0.00399	0.0224	0	0.000234	0	0	8.55085532718268e-13	3.00394614706393e-21	20.5223078573678		0.538	
C480637	2,4,6-Trimethylbenzoic acid	0	0	0	0	0.0255	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00862	0	0	0	0	0	0	0	1.35306738836514e-20	5.75189041707289e-22	21.2401893965671	EAS hi AUC low	0	
C484173	9-Phenanthrol	0	0.0482	0	0	3.04e-07	0	0	0	0.0666	0	0	0	0	0	0	0	0	0	0.0286	0	0	0	0	0	0.00909	0	6.69281387826642e-20	3.36897262333764e-26	25.4725025181319	EAS hi AUC low	0.0874	
C486566	Cotinine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.9975702357999	0.660227534572942	0.180306367518988		NA	
C486668	Daidzein	0.44	0	0.00516	0	0	0.0149	0	4.94e-05	0	0	0.0504	0	0	0	0	0	0.000131	0	0	0	0.00699	2.19e-06	0	0.00124	0	0	7.61064782957713e-14	3.10792674481644e-22	21.5075292262601		0.538	
C487069	5,7-Dimethoxy-2H-chromen-2-one	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.82293557353291e-12	3.42997643208475e-17	16.4647088640536	EAS hi AUC low	0.356	KNN hi AUC low
C489010	2,6-Di-tert-butyl-4-methoxyphenol	0.00583	0	0	0.000536	0	8.25e-07	0	0	0	0	0	0	0.000156	0.0112	0	0	0	0	0	0	0.0416	0	0	0	0	0	4.7375388148583e-19	9.30315495170274e-24	23.0313697454507	EAS hi AUC med	0.0139	
C4904614	1,5,9-Cyclododecatriene	0	0	0	0	0	0.000525	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0647	0	0	0	0	0	0.115601047750872	0.00493851245454368	2.30640384663715		NA	
C491805	Biochanin A	0.356	0	0	0	0	0.0127	5.43e-05	0.00168	0	0	0.004	0	0	0	0	0	0	0	0	0	0.0498	0	0	0.00992	0	0	7.64788164464303e-13	6.03740130755219e-20	19.2191499555259		0.538	
C493527	Methyl red	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0374	0	0.0416194018647256	0.0310341624283536	1.50815997116316		NA	
C4940118	2-Ethyl-3-hydroxy-4H-pyran-4-one	0	0	0	0	0	0.000785	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.139	0	0	0	0	8.07235316991672e-14	3.53881949941868e-17	16.4511415883672	EAS hi AUC low	0	
C49562289	Fenofibrate	2.09e-05	0	0	0	0	0.0744	0	0	0.0289	0	0	0	0	0	0	0	0	0	0	0	0.0164	2.76e-07	0	0	0	0	6.13146878066594e-15	1.22702181254255e-14	13.9111477168307		NA	
C496468	Glycoluril	0.0207	0.0618	0	0.00263	0	0	0	0	0	0	0	0	0	0	0	0.00107	0.00119	0.0242	0	0	0	0	0	0	0	0	1	0.999999999985294	6.38669259465605e-12		0	
C496720	3,4-Diaminotoluene	5.41e-05	0	0	0	0	0	0.00117	0	3.36e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.198	0.00845	0	0.0362269561307455	0.00307587868636873	2.51203079724499		0	
C499752	Isopropyl-o-cresol	0	0	0	0.0154	0	0	0	0	0	0	0	0	0	0	0.00938	0	0.0286	0	0	0	0	0	0	0	0	0	1.76905181181318e-19	1.78672624146736e-25	24.7479419841076	EAS hi AUC low	0.0402	
C499832	2,6-Pyridinedicarboxylic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00223796644411315	0.00190045904170949	2.72114148578265		0	
C500389	Nordihydroguaiaretic acid	0.0998	0.0158	0.041	0	0	0	0	0	0	0.0024	0.0241	0	0	0	0	0	0	0	0.000308	0	0	0.000114	0	0	0	0	2.75028278293525e-19	1.42451367202618e-26	25.8463333781851	EAS hi AUC med	0.163	KNN hi AUC med
C501027492	PD-0333941	0	0	0	0	0	0.00171	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.237	0	0	0.0342	0	0.000212964014778481	0.000288275991155999	3.54019152598728		NA	
C50146	Ergocalciferol	0	0.0286	0.000143	0	0	0	0	0	0	0	0	0.253	0	0	0	0	0	0	0	0	0	0	0	0	0.018	0	9.84546845025367e-11	3.75719362976592e-15	14.425136422671		0	
C50215	Lactic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.899704503498203	0.421716282624753	0.374979630387642		NA	
C50226	Corticosterone	5.64e-05	0	0	0	0	0.00111	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.189	0	0	0	0	7.41192319998664e-08	8.95406156053488e-11	10.0479799241017		0.343	KNN hi AUC low
C50271	Estriol	0.786	0.0122	0	0.0177	0	0	0.00424	0	0	0	0.0458	0	0	0	0.00307	0.000614	0	0.0016	0	0.0179	0	0	0.00414	0	0	0	8.97166350892744e-16	3.08806116876352e-25	24.510314105683		1.06	
C50282	17beta-Estradiol	0.935	0.0153	0.0183	0	0.00642	0	0	0	0	0.00095	0.0261	0	0	0	0	0	0	0	0.000272	0	0	0.00196	0	0	0	0	5.18841121146903e-16	8.33864032419607e-26	25.0789047584556		1.06	
C50293	p,p'-DDT	0.19	0	0	0	0	0.0369	0	0	0	0	0	0	0	0	0	0	0.00109	0	0	0	0.0276	2.6e-07	0	0.00414	0	0	4.95309601452744e-08	2.22512676318864e-13	12.6526452426672		0.385	
C50351	Thalidomide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.547926732466853	0.112944049675812	0.947136644434029		NA	
C50419	Clomiphene citrate	0.0293	0.588	0	0.0175	0.0519	0	0	0	0	0	0	0	0	1.55e-05	0.0342	0	0	0.00501	0.0108	0.000263	0	0	0	0	0	0	3.9845079734643e-12	2.43504513319318e-11	10.6134929847922		0.027	
C50471448	Vinclozolin	0	0.000181	0	0	0	0	0	0	0.000865	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.102	0	0.999979841299087	0.988114625994654	0.00519267226519807		NA	
C50555	Reserpine	0	0	0	0	0	0	0	0	0.076	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0766	0	3.34627931479008e-05	4.68109518424744e-05	4.32965252794473		NA	
C50594666	Acifluorfen	0	0	0	0	0	0	0	0	0.000355	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0742	0	2.92710630502619e-10	1.01193533507564e-08	7.99484723899534		0	
C50657	Niclosamide	0	7.97e-05	0	0	0	0	0.0012	0	0.00634	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.223	0	0.227	1.72360543620707e-07	4.44663928595667e-06	5.3519680993508		0	
C50704	D-Glucitol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0124896012133021	6.61549162098091e-05	4.17943787629194		0	
C50782	Aspirin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.21355510785962e-13	2.1709655705422e-15	14.6633470639901		0.0173	
C50817	L-Ascorbic acid	0	0	0	0	0	0	0.000897	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.136	0	0	0.038912086113055	0.0116624496874066	1.93321021681705		0	
C50892234	Pirinixic acid	0	0	0	0	0	0	0	0	0.00113	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.124	0	0.936646536600739	0.50136847875182	0.299842973797169		NA	
C510156	Chlorobenzilate	0	0	0	0	0	0.000258	0	0	0.000565	0	0	0	0	0	0	0	0	0	0	0	0	0.0954	0	0	0.0498	0	3.96594369177109e-14	1.58672077866269e-13	12.7994994909862		NA	
C51036	Piperonyl butoxide	0.00231	0	0	0	0	0.0818	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00922	0.0014	0	0	0	0	5.91079625636817e-15	1.88963716778232e-16	15.7236215773914	EAS hi AUC med	NA	
C51058	Procaine hydrochloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0515658873010971	0.111609876984568	0.952297370541016		0	
C5116949	Monotridecyl phosphate	0	0.0199	0	0	0	0	0	0	0.00041	0	0	0.0127	0	0	0	0	0	0	0	0	0	0	0	0	0.109	0	0.069930667821139	0.00637796535642874	2.19531784406965		0	
C51218	5-Fluorouracil	0	0	0	0	0	0.0339	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.08e-05	0	0	0	0	0.98859461264979	0.737069675601455	0.132491456104374		NA	
C51218452	Metolachlor	9.33e-05	0	0	0	0	0.128	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00794	0.00656	0	0	0	0	0.997378201107249	0.96304626187925	0.0163528501586321		0	
C51229788	Chloroallyl methenamine chloride	0.00109	0.00343	0	9.18e-07	0	0	0	0	0	0	0	0	0	0	0	0.022	0	0	0	0.0426	0	0	0	0	0	0	0.999999999963906	0.999999999999498	2.1788979106777e-13		NA	
C51235042	Hexazinone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999997418897	0.99999146456011	3.70691026491672e-06		NA	
C51241	Tiratricol	0.179	3.24e-07	1.57e-05	0	0	0.00773	0	0.000199	8.33e-05	0	0.0781	0	0	0	0	0	0	0	0	0	0.000207	0	0	0	0.00669	0	1.7257550131942e-16	1.02342061274347e-18	17.9899458401384		0	KNN low AUC hi
C512425	Sodium methyl sulfate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999985818691	6.15886448834146e-09		0	
C512561	Trimethyl phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999901204137	0.999983384986339	7.21586869567373e-06		NA	
C51285	2,4-Dinitrophenol	0	0	0	0	0	0	0	0.0203	0.00144	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0743	2.90832137625018e-08	4.9534420864809e-10	9.30509291022645		0	
C51309	Isoproterenol hydrochloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.62768119454847e-15	5.02615388538577e-17	16.2987642187775	EAS hi AUC low	NA	
C51338273	Diclofop-methyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.32645581121694e-08	4.25166533202865e-08	7.37144092810298		0	
C5137553	Methyltrioctylammonium chloride	0.00331	0.0697	0.00181	0	0	0	0	0	0	0	0	0.239	0	0	0	0	0	0	0	0	0	0	0.00102	0	0	0.0146	0.99962426417141	0.99946842308253	0.000230922303886751		0.00313	
C5138181	Sulfosuccinic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.97443220504137	0.875727758151794	0.0576308841382846		NA	
C5146667	2,6-Octadienenitrile, 3,7-dimethyl-	0	0	0	0	0	1.18e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0111	0	0	0	0	0.755683106825271	0.444493437706053	0.352134646367755		NA	
C51525	6-Propyl-2-thiouracil	0.144	0	0	0	0	4e-05	0	0	0	0	0.000383	0	0	0	0	0	0	0	0	0	0	0.00699	0	0	0	0	0.999899452542703	0.757879991201763	0.120399558596336	EAS low AUC hi	0	KNN low AUC hi
C5153253	2-Ethylhexylparaben	0.37	0.000486	1.72e-06	3.47e-05	0.00895	0	0	0.0163	0	0	0.0116	0	0	0	0.000325	0	0.00491	0	0.0156	0	0	0	0	0.000848	0	0	3.70494432094108e-12	3.69397913472086e-16	15.4325055619822		0.269	
C51580860	Sodium dichloro-s-triazinetrione dihydrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999950408508176	0.991908414542505	0.00352842552225595		0	
C51630581	Fenvalerate	0.00468	0	0	0	0	5e-05	8.71e-06	0	1.86e-05	0	0	0	0	0	0	0	0	0	0	0	0	0.0311	0	0.0965	0.00475	0	1.42715089601311e-15	1.0073588334309e-13	12.9968158009263		0.0138	
C51632167	1-(Bromomethyl)-3-phenoxybenzene	0.0607	0	0	0.00258	0	0.0112	8.95e-06	0	0	0	0	0	0	0	0.000306	0	0	0	0	0	0	0.00189	0	0.0348	0	0	1.82245599179867e-15	1.15270165713182e-17	16.9382830824949	EAS hi AUC med	0.0657	
C51707552	Thidiazuron	0	0	0	0	0	0	0	0	0.0408	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0445	0	0.999999714056145	0.97390330792388	0.0114841590552879		NA	
C51796	Urethane	0.00138	0	0	0	0	0	2.76e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.73e-05	0	0.0858	0	0	0.999999999994177	0.999999998236712	7.65786328180635e-10		NA	
C52017	Spironolactone	0.000278	6.82e-06	0	0	0	0	0	0.408	9.31e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.73e-06	0	1.02194428767219e-05	1.40272897711875e-06	5.8530262314035		0.392	KNN hi AUC med
C520183	Kaempferol	0.252	0	2.32e-06	0	0	0	0	0.00919	0	0	0.0443	0	0	0	0	0	0	0	0	0	8.85e-05	0	0	0	0	0	1.73800999255914e-12	1.08585791391156e-20	19.9642269990945		0.538	
C520365	Apigenin	0.307	0	5.11e-06	0	0	0.000446	0	0.00586	0	0	0.0675	0	0	0	6.36e-05	0	0	0	0.000102	0	0.00307	0	0	0	0	0	5.39644977058985e-13	1.15098984931048e-21	20.9389285064379		0.538	
C520456	Dehydroacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00220669955439541	0.000765743968837669	3.11591641510361		0	
C521186	5alpha-Dihydrotestosterone	0.4	0	0	0	0	0	1.71e-05	0.0395	0	0	0	0	0	0	0	0	0	0	0	0	0.00101	0	0	0.00573	0	0	2.59849793859733e-07	6.56423551521704e-10	9.18281584548545		0.524	
C5216251	4-Chlorobenzotrichloride	0	0	0	0	0	0	0.000934	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.132	0	0	6.05904391844775e-07	6.42229963936168e-11	10.1923094358163		0.19	KNN hi AUC low
C52225204	dl-alpha-Tocopheryl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.81005863631404e-16	2.43233725873739e-17	16.6139762075845	EAS hi AUC low	NA	
C52315078	Cypermethrin	0.0138	0	0	0	0	0.115	1.26e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00303	0.0038	0	0.00859	0	0	3.94048189489579e-16	6.18908154537884e-15	14.2083737951429		0.0117	
C5234684	Carboxin	0	0	0	0	0	0	0.000327	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.125	0	0	0.99995457223732	0.998089943349361	0.000830320295577195		NA	
C52517	Bronopol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999774511	0.999997886254502	9.17988975968111e-07		0	
C525791	Kinetin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.805121636052375	0.235327660875119	0.628327021997853		NA	
C525826	Flavone	0.0423	0	0	0	0	0.0777	8.15e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00041	0	0	0.0377	0	0	1.07282675509682e-13	2.43682105304356e-19	18.6131763618818	EAS hi AUC med	0.538	KNN hi AUC med
C52645531	Permethrin	0	0	0	0	0	0.0788	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00295	0.015	0	0	0	0	3.22910992935072e-15	2.0473766651847e-14	13.6888022508584		0.0138	
C526750	2,3-Dimethylphenol	0	0	0	0	0	0.0681	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0403	0	0	0	0	0	8.34529486786729e-19	1.20955486721432e-24	23.9173744266093	EAS hi AUC low	0	
C52686	Trichlorfon	0.0405	0.00361	0	0.00406	0	0	0	0	0	0	0	0	0	0	0	0.0174	8.79e-06	0.0122	0	0	0	0	0	0	0	0	0.815232384585086	0.335786639799635	0.47393658746159		NA	
C527606	2,4,6-Trimethylphenol	0	0	0	0	0	3.3e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0311	0	0	0	0	0	2.54869083176506e-18	1.12563142269447e-24	23.9486037918061	EAS hi AUC low	0.00488	
C527680564	PHA-00568487	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.74246714267127e-06	1.06770448269923e-05	4.97154893391089		NA	
C52806538	Hydroxyflutamide	0	0	0	0	0	0	0	0.0939	1.62e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0171	0.444117557039956	0.21165112978268	0.674379408942515		0	
C528290	1,2-Dinitrobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0342	0	0	0.890420961724591	0.447518358650655	0.349189143818166		0	
C52868	Haloperidol	0.00598	0	0	0	0	0.000586	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.159	0	0	0	0	3.64524363666528e-15	1.15434087481201e-10	9.93766592585122		NA	
C52918635	Deltamethrin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.02419401664872e-15	2.09472329599176e-15	14.6788733373567		0.0138	
C53032	Prednisone	0.0991	0	0	0	0	2.59e-05	5.68e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0405	0	0.0187	0	0	1.74042306034138e-07	3.84345268424523e-10	9.41527846104917		0.495	KNN hi AUC med
C53112280	Pyrimethanil	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.996380773252515	0.706039664609483	0.15117090002873		0.0356	
C5315797	1-Hydroxypyrene	0.00941	0	0	0	0	0.0596	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00956	0.000298	0	6.59e-06	0	0	1.08514001549723e-19	3.76419699894664e-26	25.4243276558833	EAS hi AUC med	0.0874	
C53167	Estrone	0.807	0.00246	0	0	0.0535	0	0.00402	0	0	0	0	0	0	0	0	0	0	0	0	0.0178	0	0	0	0	0	0	1.21885750703273e-17	2.2295713577247e-26	25.6517786234399		1.06	
C53190	o,p'-DDD	0.236	0	0	0	0.00379	0.0565	2.44e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0192	0.000765	0	0.00645	0	0	5.93794414383374e-08	9.97910854711896e-13	12.0009082533378		0.385	
C532025	Sodium 2-naphthalenesulfonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.90343640717922e-09	2.44702717080442e-11	10.6113612083904		0	
C53219219	7-Octen-2-ol, 2-methyl-6-methylene-, dihydro deriv.	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.30525276825778e-08	1.42927272952241e-09	8.84488489253495		0	
C532274	2-Chloroacetophenone	0.0137	0	0	0	0.0103	0.000989	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0227	0	0	0	0	0	2.85241614754952e-16	9.67497326479498e-16	15.0143502264091	EAS hi AUC med	0.0491	
C532321	Sodium benzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.2220197382194e-14	1.92250504718316e-16	15.7161325113648	EAS hi AUC low	0	
C5329146	Sulfamic acid	0	0	0	0	0.000172	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0319	0	0	0	0	0	0	0	0.999999997770424	0.999452338880427	0.000237911355531469		0	
C533233	2,4-D-ethyl ester	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.74310608252535e-07	4.19921460263298e-07	6.37683192999227		0	
C5333426	2-Octyl-1-dodecanol	0	0	0.000476	0	0	0	0	0	0	0	0	0.151	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.06480884506044e-05	8.42798373452524e-07	6.07427631122397		0.0021	
C533744	Dazomet	0	8.83e-05	0	0	0	0	0	0	0.000883	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.147	0	1	1	4.82163733276644e-17		NA	
C534134	N,N'-Dimethylthiourea	0	0	0	0	0	0.0438	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0162	0	0	0	0	0	1	1	4.82163733276644e-17		0	
C53430	Dehydroepiandrosterone	0.365	3.01e-07	0.00195	0	0	0	0.00334	0	0	0	0.000813	0.0339	0	0	0	0	0	0	0	0	0	0	0	0.0535	0	0	1.55272208847473e-08	3.79521216588059e-12	11.4207639404811		0.495	
C534521	2-Methyl-4,6-dinitrophenol	0	0.000304	0	0	0	0	0	0	0.0776	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.042	2.75176462585398e-11	6.62389138017611e-13	12.1788867978079		0	
C5349519	4-(2-Methylbutan-2-yl)cyclohexanol	0.248	0	3.93e-05	0	0	0.008	0	0.00421	0	0.000386	0.00336	0	0	0	0	0	0	0	0	0	6.12e-08	0.0188	0	0	0	0	1.04305194985631e-10	2.42967911167314e-13	12.6144510799951		0	KNN low AUC hi
C53703	Dibenz(a,h)anthracene	0	0	0	0	0	0.000893	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.295	0	0	0	0	3.09338933005262e-15	1.37451690054669e-18	17.8618499158649	EAS hi AUC low	0.0372	
C53861	Indomethacin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.971218894974e-07	1.01609886168251e-05	4.99306403516782		NA	
C53894238	Triisononyl trimellitate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.05057401844431e-08	5.69025856998442e-10	9.24486799846152		0.115	KNN hi AUC low
C5392405	3,7-Dimethyl-2,6-octadienal	0	0	0	0	0	2.84e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0234	0	0	0	0	0.165069806305724	0.0573516920335733	1.24145376468505		0	
C53939289	(Z)-11-Hexadecenal	0.0879	0	0	0	0	0.000484	0	0.0466	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0125	0	0	0	0	0.0180303243715887	0.00149589315260179	2.82509942578482		0.0319	
C5394365	5-Ethyl-5-methylhydantoin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999992677955	0.999861456106771	6.01730167288051e-05		0	
C540181	Pentyl butyrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.954136087250061	0.649679263592518	0.187300994787754		0	
C5407987	Cyclobutyl phenyl ketone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.77483334811257e-21	3.51183427126923e-19	18.4544659872909	EAS hi AUC low	0.0191	
C540885	tert-Butyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.964842977468406	0.717120127849573	0.14440808771816		NA	
C541026	Decamethylcyclopentasiloxane	0	0	0	0.0302	0	0	0	0	0	0	0	0	0	0.0165	0	0.00855	0	0.00221	0	0	0	0	0	0	0	0	0.999999996910824	0.99983613391043	7.11719699668761e-05		0	
C54115	Nicotine	0	0	0	0	0	0.0637	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0134	0	0	0	0	0.99401385617864	0.613633833176855	0.212090703236169		NA	
C541731	1,3-Dichlorobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.76172300920186e-05	1.57686074017064e-07	6.80220665952207		0.00153	
C542927	1,3-Cyclopentadiene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0611409089539545	0.0013910807583425	2.85664765657558		NA	
C5437456	Benzyl bromoacetate	0.00188	0	0	0	0	0	0.000642	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00213	0	0.109	0	0	2.8291450956992e-08	1.45919722063296e-08	7.83588600622572		0	
C544638	Tetradecanoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0238213057034656	0.000903548162824852	3.044048692808		0.248	KNN hi AUC low
C544763	Hexadecane	0	0	0	0	0	0	4e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0495	0	0	0.228578900361412	0.00936329729879869	2.02857118689185		0	
C54593838	Chlorethoxyfos	0.0203	0	0	3.04e-05	0	0.038	7.34e-06	0	0	0	0	0	0	0	0	0	0.00973	0	0	0	0.00375	0.00452	0	0.0205	0	0	0.999844890277578	0.996410542996736	0.00156168585142718		NA	
C54626	4-Aminofolic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.941716659324001	0.531337500955389	0.274629531195021		0	
C54853	Isoniazid	0	0	0	0	0	0.000703	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0815	0	0	0	0	0.983877565818521	0.589759319073061	0.229325187890386		0	
C548629	Gentian Violet	0	0.000394	0	0	0	0	0	0	0.238	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0052	0	0.199698549022086	0.117898849619273	0.928490432448924		0.0518	
C54965241	Tamoxifen citrate	0.027	0.546	0	0.0605	0	0	0	0	0	0	0	0	0	0	0.0107	0.00189	0.0232	0.000612	0.0595	0	0	0	0	0	0	0	1.76784130209729e-12	1.52813584350867e-12	11.8158380374724		0.0293	
C550447	N-Methylphthalimide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0270815976143885	0.0479824559077185	1.31891752710862		0.00292	
C55185	N-Nitrosodiethylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999999	1	0		0	
C55219653	Triadimenol	0.0188	0	0	0.000331	0	0.0291	0	0	0	0	0	0	0	0	2.29e-05	0.000769	0	0.00032	0	0	0.00551	0.0171	0	0	0	0	3.70054396482239e-10	1.90389439603828e-09	8.72035714444407		0.0039	
C552307	Trimellitic anhydride	0	0.000172	0	0	0.0635	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0359	0	0	0	0	0	0	0	9.14757550984936e-14	4.02775024642693e-17	16.3949374671059	EAS hi AUC low	0	
C55283686	Ethalfluralin	0.0346	0	0	0	1.27e-06	0.0358	0	0	0	0	0	0	0	0	0.00346	0	0	0	0.0468	0	0.00167	0.00343	0	0	0	0	0.83785831160746	0.738379020379701	0.131720651449597		0.224	KNN hi AUC med
C55285148	Carbosulfan	0.0115	0	0	0	0	0.0395	0	0	4e-05	0	0	0	0	0	0	0	0	0	0	0	0	0.032	0	0	0.0024	0	3.4414178243105e-09	1.21349854121774e-08	7.91596074140989		0	
C55290647	Dimethipin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998144270664838	0.951820257780606	0.0214450562627193		NA	
C553264	4,4'-Bipyridine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.232811854292201	0.0408882884989065	1.38840106775422		0.0171	
C55335063	Triclopyr	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.290023060476632	0.0876943865118206	1.05702820577839		0	
C5536618	Sodium methacrylate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.900392237669523	0.815637760150867	0.0885026766585454		NA	
C553708	Magnesium dibenzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.45755951948891e-14	3.80062647183453e-17	16.4201448110579	EAS hi AUC low	0	
C55389	Fenthion	0.00263	0	0	0	0	0.146	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0093	0.0053	0	0	0	0	4.51521693467852e-15	2.00389554393256e-17	16.6981249204675	EAS hi AUC med	0.00268	
C55406536	3-Iodo-2-propynyl-N-butylcarbamate	0	0.0283	0	0	0	0	0	0	8.16e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0147	0.999999998192479	0.999999989236952	4.67433243187921e-09		NA	
C55512339	Pyridate	0	0	0	0	0	0	0	0.0843	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.12017483314547e-07	8.7509163123846e-05	4.05794646942604		NA	
C55589623	Acesulfame potassium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.9999999099838	0.999999544722003	1.97724766825514e-07		NA	
C556525	Glycidol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.994039418762986	0.169205180556504	0.771586344295459		NA	
C556616	Methyl isothiocyanate	0	0	0	0	0	0	2.7e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0423	0	0	1	1	0		NA	
C556672	Octamethylcyclotetrasiloxane	0	0	0	0	0	0.153	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00564	0.0111	0	0	0	0	0.999999999880369	0.999998113660506	8.19227605788584e-07		0.0268	
C55814410	Mepronil	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.20294107224349e-07	1.58390963439211e-05	4.80026959951695		0	
C55934935	Tripropylene glycol butyl ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.875411785815559	0.27516567713878	0.560405738891681		0	
C55981	Busulfan	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999994759596346	0.992720134943901	0.00317316941055344		NA	
C5598130	Chlorpyrifos-methyl	6.35e-05	0	0	0	0	0.0812	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0263	0	0	0	0	0.211758023011096	0.118592304181078	0.925943492760404		0.0125	
C5598152	Chlorpyrifos oxon	0	0.000174	0	0	0	0	1.56e-05	0	0.0717	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00904	0	0.152	0	0.288078635180268	0.181390651515529	0.741385099303707		0.0125	
C56042	6-Methyl-2-thiouracil	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.967488878288172	0.797139239807088	0.0984658118558354		0.144	KNN hi AUC low
C563122	Ethion	0.0974	0	0	0.00249	0	0.0088	0	0	0	0	0	0	1.93e-05	0	0.00879	0	0.00129	0	0.00305	0	0.0105	0	0	0.000389	0	0	0.999999929378458	0.999819450021284	7.84189389461174e-05		0.0181	
C56375792	N,N-Dibutyl-N-methylbutan-1-aminium chloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999451182	0.999999995887734	1.78593442351243e-09		0.00331	
C56382	Parathion	0	0	0	0	0	0.115	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00272	0.000731	0	0	0	0	4.95978576484266e-05	8.39939143507624e-06	5.07575217893367		0.0868	
C56531	Diethylstilbestrol	0.943	0.00992	0	0	0.00428	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00263	0	0	0	0	0	0	2.96648033512605e-17	1.06290654635042e-25	24.9735049181564		0.491	
C56553	Benz(a)anthracene	0.0372	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000506	0	0	0.0502	0	0	0.000368	0	0	3.13915589080396e-15	1.53402543825905e-18	17.8141674385592	EAS hi AUC med	0.0112	
C56724	Coumaphos	0	0	0	0	0	0.000188	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.123	0	0	0	0	5.80055990801033e-14	7.45663228107928e-17	16.1274572733283	EAS hi AUC low	NA	
C56815	Glycerol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.939289487019767	0.0210946419736886	1.67582784123118		0	
C56951	Chlorhexidine diacetate	0.00201	0.132	0.0513	0	0	1.82e-07	0	0	0	0	0.00253	0	0	0	0	0	0	0	0	0	0	0.000695	0	0	0.00757	0	0.99727609711993	0.993337839444933	0.00290302053438326		NA	
C5700492	1,2-Ethanediamine dihydriodide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999896656	0.999999999999966	1.47542102382655e-14		NA	
C57067	Allyl isothiocyanate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999987	1	9.64327466553287e-17		NA	
C57090	Hexadecyltrimethylammonium bromide	0.000761	0.0837	0.000244	0	0	0	0	0	0	0	0	0.0892	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99885544168051	0.998889204549797	0.000482680463835671		0.0071	
C57103	Hexadecanoic acid	0.00386	0	0	0	0	1.1e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0237	0	0.0606	0	0	0.0262525702019687	0.00094833143785581	3.02303985203383		0.248	KNN hi AUC med
C57114	Octadecanoic acid	0.248	0	0	0	0	0.00059	0.000422	0.00404	0	0	0	0	0	0	0	0	0	0	0	0	0.002	0.000731	0	0.0445	0	0	0.0480011722777634	0.00159452360066103	2.7973690483489	EAS low AUC hi	0.00386	
C57136	Urea	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.99999999999906	4.08440898458837e-13		0	
C57147	1,1-Dimethylhydrazine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999999	5.30380106604308e-16		NA	
C571584	1,4-Dimethylnaphthalene	0	0	0	0	0	0	0.000182	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0718	0	0	4.69826319168339e-15	8.89910808979694e-19	18.0506535181967	EAS hi AUC low	0	
C57307	Phenobarbital sodium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.4502981674666e-07	0.000258839522584827	3.58696940988123		NA	
C57410	5,5-Diphenylhydantoin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0331355421752983	0.0370614756571607	1.43107729259933		NA	
C57501	Sucrose	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00555601825944114	0.000358433229841883	3.44559173431131		0	
C57556	1,2-Propylene glycol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.954968523626952	0.0789621843351367	1.10258084626072		0.0156	
C576261	2,6-Dimethylphenol	0	0	0	0	0	0.000185	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.105	0	0	0	0	0	6.20452787820914e-18	8.37167774264132e-24	23.0771874976394	EAS hi AUC low	0	
C57636	17alpha-Ethinylestradiol	1	0	0	0	0	0	0.00294	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.22074425307444e-16	5.4495487570365e-26	25.2636394574376		1.06	
C577117	Docusate sodium	0	0	0	0	0	0	0	0	0.000469	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0572	0	0.711263250022593	0.393198729120988	0.405387894544465		0	
C57749	Chlordane	0.0191	0	0	0	0	0.152	0	0	0.0145	0	0	0	0	0	0	0	0.000117	0	0	0	0.00875	0.0145	0	0	0	0	3.33370311180522e-10	6.50040154533109e-13	12.187059815121		0	
C57754855	Clopyralid-olamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.721589982517603	0.364995187147618	0.43771286214356		0	
C57830	Progesterone	0.0507	0.000618	0	0	0	0	2.34e-05	0	0.0129	0	0.00496	0	0	0	0	0	0	0	0	0	0.0026	0.0111	0	0.00723	0	0	2.21227279714227e-07	4.03438477327494e-11	10.3942226839762		0.343	KNN hi AUC med
C57837191	Metalaxyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999954234132716	0.99809153907659	0.000829625954369861		NA	
C57852	Testosterone propionate	0.392	0	0	0	0	0.123	5.42e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000235	0	0.000711	0	0	5.66105773152998e-06	2.85778477167065e-07	6.54397048233145		0.495	
C57910	17alpha-Estradiol	1.06	0	0	0	0.0207	0	0	4.52e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.18841121146903e-16	8.33864032419607e-26	25.0789047584556		1	
C579668	2,6-Diethylaniline	0	0	0	0	0	0.00383	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0129	0	0	0	0	0	0.00154781323447723	5.43857086860514e-05	4.26451520791573		0.139	KNN hi AUC low
C57966957	Cymoxanil	0	0	0	0	0	4.26e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0634	0	0	0	0	0.999999999999996	0.999999999999997	1.4947075731576e-15		NA	
C57976	7,12-Dimethylbenz(a)anthracene	0.000165	0	0	0	0	0.2	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0211	0.00146	0	0	0.0174	0	3.30301150003588e-15	1.06754070006971e-18	17.9716155584774	EAS hi AUC med	0.0372	
C58082	Caffeine	0	0	0	0	0	0.000562	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0772	0	0	0	0	0	0.9999986627822	0.965742790253512	0.0151385253936555		0	
C58140	Pyrimethamine	0	0	0	0	0	0.00105	0	0	0.00137	0	0	0	0	0	0	0	0	0	0	0	0	0.153	0	0	0	0.037	0.436667552802081	0.105516331170786	0.976680317726882		NA	
C58184	17-Methyltestosterone	0.495	0	0	0	0	0.0491	0	0.00123	0	0	0	0	0	0	0	0	0	0	0	0	0.00589	0.00717	0	0.000909	0	0	1.08357502091057e-07	1.7313656995531e-11	10.761611190632		0.524	
C583788	2,5-Dichlorophenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.99362656565533e-15	3.87919657413001e-19	18.4112582124348	EAS hi AUC low	0.00613	
C58394642	Benzyloctyl adipate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.7176864218104e-06	6.26368402245264e-07	6.20317015879916		0	
C584134	4-Amino-1,2,4-triazole	7.51e-09	0	0	0	0	0.0843	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0319	0	0	0	0	0.999999999999822	0.999997142400269	1.24104156793899e-06		0	
C58430947	3,5,5-Trimethylhexyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0807673287200259	0.0163072421288166	1.78761948037668		0	
C584792	Allethrin	0	0	0	0	0	0.000439	0	0	0.0633	0	0	0	0	0	0	0	0	0	0	0	0	0.0282	0	0	0	0.0165	4.79088231361999e-05	5.87147433306472e-06	5.23125283328076		0	
C584849	Toluene-2,4-diisocyanate	0	0	0	0	0	8.31e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0512	0	0	0	0	0.104349976993727	0.0454190095413974	1.34276234073266		0	
C5850862	C.I. Acid Orange 8, monosodium salt	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.43856196376448e-11	2.53334882612627e-13	12.596305006486		0	
C585342	3-tert-Butylphenol	0.0248	0	0	0.0264	0	0.0377	0	0	0	0	0	0	0	0	0.000387	0	0	6.93e-05	0	0	0.0302	0.0203	0	0	0	0	5.29633809317079e-18	7.25541585811258e-27	26.1393376900894	EAS hi AUC med	0.0402	
C58559	Theophylline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999996104583583	0.939154376966644	0.0272630131076327		0	
C58560	Pyridoxine hydrochloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.16618462846053e-09	6.31708746738862e-08	7.19948310975416		0	
C586629	Terpinolene	0.00827	0	0	0	0	0.0832	9.54e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00465	0.00634	0	0.0111	0	0	0.000260285025536051	5.7350497515549e-06	5.24146281024187		0	
C5870939	Heptyl butanoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.670714676656246	0.21356613692748	0.670467607970308		0	
C58720	Triphenylethylene	0.383	0	0	0	0	0.00554	0	0.000512	0	0	0	0	0	0	0	0	0	0	0	0	0	0.053	0	0.000346	0	0	3.15035395067757e-12	3.34748293123224e-15	14.4752816287717		0.0207	
C587655	2-Chloro-N-phenylacetamide	0	0.00669	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00407	0	0	0	0	0.00906	0	0.999954444507317	0.985926971527471	0.00615525243933935		NA	
C587859	Diphenylmercury(II)	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.52685610243375e-06	4.57584630308545e-11	10.3395285713748		NA	
C58846778	Decyl beta-D-glucopyranoside	0.000123	0	0	0	0	0	0	0.249	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00287659600836787	0.000220824577959644	3.65595259091471		0	
C58855	Biotin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.896946483748715	0.874424559376107	0.0582776531492317		NA	
C58866	D-Xylose	0	0	0	0	0	7.57e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0154	0	0	0	0	0.0517004035036276	0.00222873775241234	2.65194103038949		0	
C58899	Lindane	0.00306	0	0	0	0	0.117	0	0	0	0	0	0	0	0	0	0	0.0021	0	0	0	0.00215	0.00249	0	0	0	0	0.00230922065142162	0.000100736415396988	3.99681350713133		0.082	
C58935	Hydrochlorothiazide	0	0	0	0	0	0.000551	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.119	0	0	0	0	0.999692634092603	0.930179487767321	0.0314332417409571		NA	
C589684	Tetradecanoic acid, 2,3-dihydroxypropyl ester	0	0	0	1.32e-05	0	0	0	0	0	0	0	0	0.0873	0	0	0	0	0	0	0	0	0	0	0	0	0	0.214073216299751	0.031912298282436	1.49604191735344		0	
C5902512	Terbacil	0	0	0	0	0	2e-04	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0705	0	0	0	0	0.983723006178876	0.641185788746326	0.193016111922147		0	
C59052	Methotrexate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.974990639354153	0.638915337074278	0.194556686563773		0	
C5915413	Terbuthylazine	0.057	0	0	0	0	3.41e-07	0.0506	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0118	0	0	0.063	0	0	0.999999073532244	0.999999756594457	1.05709696933733e-07		0.00394	
C59227893	Laurocapram	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999251191715421	0.988957904937856	0.00482219378429561		0	
C59303	Folic acid	0	0	0	0	0	0	0.000593	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0885	0	0	0.828790720044667	0.290244727030726	0.537235661485204		0	
C59405	Sulfaquinoxaline	0	0	0	0	0	0	3.4e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0486	0	0	0.999976257368685	0.836652975065378	0.0774546402930569		NA	
C594207	2,2-Dichloropropane	0	0	0	0	0	0.0233	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00773	0	0	0	0	0	0.641924539012752	0.613987695647082	0.211840332060981		NA	
C59507	4-Chloro-3-methylphenol	0.0285	1.91e-07	0	0.00312	0	0.0206	0	0	0	0	0	0	0	0	0.00138	0.00124	0.0139	0.00102	0	0	0.0126	0	0	0	0	0	1.46911429737907e-17	3.15415575502565e-22	21.5011168646286	EAS hi AUC med	0.138	KNN hi AUC med
C59669260	Thiodicarb	0	0	0	0	5.03e-08	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0205	0	0	0	0	0	0	1	1	0		0	
C59676	Nicotinic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0016763834495289	0.000755381268003107	3.12183378903954		0	
C59756604	Fluridone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.95679689221251e-05	0.00087444191483935	3.05826903341522		NA	
C598550	Methyl carbamate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999994336	2.45990293443775e-12		NA	
C59870	Nitrofurazone	0	0	0	0	0	8.49e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0145	0	0	0	0.0292	0.414445028993703	0.195273997746295	0.709355582555048		0	
C599644	4-Cumylphenol	0.376	6.62e-08	0.000633	0	0	0.0315	0	2.31e-06	0	0.000957	0.0157	0	0	0	0	4.16e-05	6.5e-05	0	0	0	0.0263	0	0	0.00122	0	0	3.50825253229349e-17	9.08713591270642e-28	27.0415729763277		0.552	
C599791	Sulfasalazine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.95226905383644e-05	0.00018313707978682	3.73722371513876		NA	
C60093	4-Aminoazobenzene	0.0658	0	0	0	0	0	0.00043	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.12	0	0	0.293650790889398	0.0568343343476117	1.24538922216272		0.0201	
C60128	2-Phenylethanol	0	0	0	0.000293	0	0	0	0	0	0	0	0	0	0	0	0	0	0.123	0	0	0	0	0	0	0	0	2.47928822258976e-16	1.03025671735081e-17	16.9870545451617	EAS hi AUC low	0	
C60168889	Fenarimol	0.105	0.000907	0	0	0	0.0105	0.00018	0	0	0	0	0	0	0	0	0	0.000112	0	0	0	0.0222	0.00102	0	0.0127	0	0	7.19864050822787e-09	1.00466878099987e-06	5.997977092764		NA	
C602017	2,3-Dinitrotoluene	6.13e-05	0	0	0	0	0.000941	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.136	0	0	0	0	0.229154077828046	0.0451348168598362	1.34548831540483		0	
C60207901	Propiconazole	4.37e-05	0	0	0	0	0	0	0	0.0332	0	0	0	0	0	0	0	0	0	0	0	0	0.0815	0	0	0	0.00083	0.000350376953800545	0.000545890501139653	3.26289446264316		0	
C60333	Linoleic acid	0	0.0336	0.0239	0	0	0	0	0	0	0	0.03	0.000367	0	0	0	0	0	0	0	0	0	0	0	0	0.0118	0	0.00413717338343355	0.00015172167137945	3.81895238171619		0.00457	
C603350	Triphenylphosphine	0.0652	0.00198	0	0.000883	0	0.0104	0	0	0	0	0	0	0	0	0.00291	0	0.00259	0	0.000509	0	0.0466	0	0	0	0	0	1.85056633142008e-05	3.77022722492982e-10	9.42363247484476		0.101	KNN hi AUC med
C60355	Acetamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999995818	0.999999999904856	4.13205640490542e-11		0	
C604751	Oxazepam	0.00109	0	0	0	0	0.267	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00469	0	0	0	0	0	0.394076730596232	0.127281236630037	0.895235613853365		NA	
C60515	Dimethoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999998	7.7146197324263e-16		NA	
C605458	Diisopropyl phthalate	0.00932	0	0	0	0	0.0754	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0258	0	0	0	0	0	7.47160162768403e-11	1.25094294923806e-12	11.9027624963786		0.0283	
C60548	Tetracycline	0	0	0	0	0	0.0547	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.024	0	0	0	0	1.68643369213994e-12	2.44162040712378e-13	12.612321853866		0	
C6055192	Cyclophosphamide monohydrate	0.135	0	0	0	0	0.0348	0.000321	0.0246	0	0	0	0	0	0	0	0	0	0	0	0	0.000117	0.0311	0	0.0144	0	0	1	0.99999999990792	3.99896474959660e-11	EAS low AUC hi	NA	
C60560	Methimazole	0	0	0	0	0	0	0.00102	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.274	0	0	0.999999999928312	0.99999881039452	5.16639402716814e-07		NA	
C60571	Dieldrin	0.0181	0	0	0	0	0.149	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00442	0.0749	0	0	0	0	1.23153660079051e-11	7.07957537682867e-16	15.1499927899134	EAS hi AUC med	0.00739	
C606202	2,6-Dinitrotoluene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.186714253075098	0.0299245996209346	1.52397165156757		0	
C6088513	6-Hydroxy-2-naphthyl disulfide	0.25	0	0	0	0	0.00976	0	0.0562	0	0	0	0	0	0	0	0	2.84e-05	0	0	0	0	0.000275	0	0	0	0	2.69327924997313e-18	2.32641743419818e-23	22.6333123562012		0.0874	
C609541	2,5-Dimethylbenzenesulfonic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.8723556769571e-11	1.26176706624028e-12	11.8990208124323		0.0123	
C611201	Benzonitrile, 2-hydroxy-	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.27740656824198e-17	3.67010674125955e-21	20.4353213045583	EAS hi AUC low	0.0303	
C611701	Isopropyl phenyl ketone	0.00034	0	0	0	0	0.391	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0121	0.00537	0	0	0	0	3.78162271693998e-20	1.82819971918391e-18	17.7379763621024	EAS hi AUC med	0.0491	
C612828	3,3'-Dimethylbenzidine dihydrochloride	0.143	0.000299	0.166	0	0	0	0	0	0	0.0147	0.0325	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00741028555933915	0.00024996975415412	3.60211253692246	EAS low AUC hi	0.139	
C614459	tert-Butyl perbenzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.55983276866074e-15	6.93285587669765e-18	17.1590878280149	EAS hi AUC low	NA	
C6149037	Sodium 4-octylbenzenesulfonate	0	0	0	0	0	6.43e-05	0	0	0.00116	0	0	0	0	0	0	0	0	0	0	0	0	0.007	0	0	0.0985	0	4.68653846677557e-09	1.97354379783928e-11	10.7047532310881		0	
C6152336	Sodium 2-phenylphenate tetrahydrate	0	0	0	0	0	0.068	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0281	0	0	0	0	1.18763976454812e-17	1.72162104391574e-22	21.7640624374632	EAS hi AUC low	0.219	KNN hi AUC low
C6153646	Oxytetracycline dihydrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.94297130755947e-13	1.02368364092254e-13	12.9898342369436		0	
C616455	2-Pyrrolidinone	0	0	0	0	0	0	0.00109	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.12	0	0	0.99999999990228	0.999999976061536	1.03963428436001e-08		NA	
C61734	Methylene blue	0.00154	0.0591	0	0.0142	0.0113	0	0	0	0	0	0	0	7.97e-05	0	0	0.0423	0	0.00541	0	0	0	0	0	0	0	0.00108	0.999977161311583	0.957922319253359	0.0186697077142197		NA	
C61791126	Cremophor(R) EL	0	0	0	0	0	0.000626	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00718	0	0	0	0	0	-1	-1	0		NA	
C61825	Amitrole	0	0	0	0	0	0	2e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0537	0	0	0.999999999988109	0.99999195879317	3.49226579527198e-06		0	
C618451	3-Isopropylphenol	0.00783	0	0	0.00425	0	0.0558	0	0	0	0	0	0	0	0	0.00285	0	0.0018	0.0104	0	0	0.00171	0.00471	0	0	0	0	6.39122243938957e-18	4.17261793222916e-25	24.3795913798512	EAS hi AUC med	0.0248	
C6190654	Deethylatrazine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999995732759	0.999999993495731	2.8247682464647e-09		0.00394	
C620177	3-Ethylphenol	0	0	0	0	0	0	0.00142	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0712	0	0	2.06229301815545e-17	2.65500544066136e-24	23.5759345846214	EAS hi AUC low	0.0248	
C621647	N-Nitrosodipropylamine	0	0	0	0	0	0.000527	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0873	0	0	0	0	0.999999999965834	0.999999999976426	1.02382647125169e-11		0	
C62237	4-Nitrobenzoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.80299057355266e-08	7.3516691076725e-08	7.13361404840458		0	
C622979	4-Methylstyrene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.01271075249264e-11	3.20236722893964e-15	14.4945288671833		NA	
C62384	Phenylmercuric acetate	0	0.164	0	0	0	0	0	0	0.0296	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0676	0	0.000718855200821628	0.00118229797902676	2.92727305277985		NA	
C625558	Isopropyl formate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999917271157491	0.969615622532897	0.0134003957302107		0.0152	
C62566	Thiourea	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999977	9.83614015884364e-15		NA	
C6259763	Hexyl salicylate	0.0173	0	0	0	0	0.0338	1.23e-06	0	0	0	0	0	0	0	0.000113	0	0	0	0	0	0	0.024	0	0.0079	0	0	6.37971731285988e-12	3.74355000017005e-13	12.4267163619074		0	
C626437	3,5-Dichloroaniline	0	0	0	0	0	0	0.000709	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0643	0	0	0.532892162882908	0.141720612293341	0.848566979997873		0	
C62737	Dichlorvos	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999846141726945	0.99974708372482	0.000109854035216644		NA	
C62748	Sodium fluoroacetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999917687437	0.999937365868754	2.72025094905463e-05		0	
C62759	N-Nitrosodimethylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		NA	
C627930	Dimethyl adipate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.836101763017182	0.355762045548022	0.448840386460897		0	
C6285058	Ethyl 4-chlorophenyl ketone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0307	0	0	0	0	2.26247969220617e-18	1.80466508934968e-16	15.7436033828679	EAS hi AUC low	NA	
C628637	Pentyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.971220090938928	0.73222640321373	0.13535461502935		0	
C62924703	Flumetralin	0.224	0	0	0	2.09e-07	0.00417	2.78e-05	0.0396	0	0	0	0	0.000579	0	6.59e-06	0	0	0	0.000582	0	0.00218	0	0	0.00639	0	0	0.997309055119752	0.805494276696329	0.0939375410399622	EAS low AUC hi	0.0398	
C629629	Pentadecane	0	0	0	0	0	9.87e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0475	0	0	0	0	0.228578900361412	0.00936329729879869	2.02857118689185		0	
C629765	1-Pentadecanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0232132941280827	0.000330728057969953	3.48052895929064		0.00481	
C630568	Hydroxyprogesterone caproate	0.0177	0.0202	0	0	0	0	0	0.284	0.0232	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.23614995483246e-06	4.82748071284722e-07	6.31627945267457		0.392	KNN hi AUC med
C63058	4-Androstene-3,17-dione	0.183	0	0	0	0	0	1.5e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0956	0	0.023	0	0	2.25241417955778e-07	5.72702317122378e-11	10.2420710597513		0.495	
C6317186	Methylene bis(thiocyanate)	0	0	0	0	0	0	0	0	0.000602	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0592	1	1	0		NA	
C63252	Carbaryl	0.00877	0	0	0.00205	0	0.0569	0	0	0	0	0	0	0	0	0	0	0.00114	0.0192	0	0	0.0108	5.6e-07	0	0	0	0	6.93762928275591e-14	1.24961437615034e-13	12.9032239871105		NA	
C633965	C.I. Acid Orange 7	0	0	0	0	0	0.000248	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.081	0	0	0	0	3.89303923066376e-11	2.04539830594739e-13	12.6892221080814		0	
C63423	Lactose	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00874557985032873	0.000521950193024852	3.28237093746995		0	
C6344678	3-Hydroxyfluorene	0.0945	0	0	0.00764	0	0.00798	0	0	0	0	0	0	0	0	1.2e-05	0.00012	0.00313	0	0	0	0	0.0101	0	1.97e-05	0	0	1.25476181624827e-20	1.73880247008846e-27	26.7597497515356	EAS hi AUC med	0.0874	
C63449412	C8-18-Alkydimethylbenzyl ammonium chlorides	0.0312	0.029	2.37e-06	0	0	0	0	0	0	0	0	0.0678	0	0	0	0	0	0	0	0	0	0.0178	0	0	0	0	0.09781717222695	0.155584109509502	0.808034761489958		0.00313	
C6359826	Acid Yellow 11	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999788513095	0.977120345075811	0.0100519439745258		0	
C6359906	C.I. Acid Yellow 34, monosodium salt	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999010380805	0.984501624693092	0.00678356282229545		0	
C6359984	C.I. Acid Yellow 17, disodium salt	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999998474706399	0.975567597236633	0.0107426328919554		0	
C63612500	Nilutamide	0	0	0	0	0	0	0	0	0.000564	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.094	0.998558995591699	0.710883706514658	0.148201439706025		NA	
C636215	2-Methylaniline hydrochloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0333138959153892	0.00258112703324658	2.58819062060903		0.143	KNN hi AUC low
C637070	Clofibrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.95409002685974e-09	1.47834237157611e-08	7.83022497536795		NA	
C6381777	Sodium erythorbate (1:1)	0	0	0	0	0	0.147	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.22e-05	0.0145	0	0	0	0	0.0555678785928116	0.0183344113762428	1.73673302844421		0	
C64108	Urea, phenyl-	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999370550900471	0.927779392954431	0.0325552778892229		0	
C6422862	Bis(2-ethylhexyl) terephthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.94702957174812e-08	1.68774738012714e-09	8.77269255748947		0.37	KNN hi AUC low
C64359815	4,5-Dichloro-2-octyl-3(2H)-isothiazolone	0.00534	0.0651	0.0484	0	0	0	0	0	0	0.0175	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.987837455065977	0.987314172611256	0.00554462876872002		0	
C643798	1,2-Benzenedicarboxaldehyde	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0389	0	1.56654834252981e-17	2.00919345724304e-17	16.6969782447509	EAS hi AUC low	NA	
C644973	Phenyl phosphorus dichloride	0	0	0	0.000332	0	0	0	0	0	0	0	0	0.147	0	0	0	0	0	0	0	0	0	0	0	0	0	4.46539469718135e-05	4.39649440536494e-08	7.35689347515474		0.0652	
C645567	4-Propylphenol	0.0275	0	0	0.0369	0	0.0185	0	0	0	0	0	0	0	0	0.00164	0.000541	0.00182	0.000423	0	0	0.0322	0	0	0	0	0	2.75128215463337e-16	3.26984506825871e-25	24.4854728245857	EAS hi AUC med	0.943	KNN hi AUC med
C645625	2-Ethyl-2-hexenal	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.194800891703023	0.0925835705913973	1.03346607416632		0	
C6459945	C.I. Acid Red 114	0	0.0473	0	0	0	0	0	0	0.000398	0	0.00576	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0152	5.17595263957405e-12	2.05935786176105e-13	12.686268177965		0	
C64675	Diethyl sulfate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999453822	0.999934691099419	2.83642213694357e-05		NA	
C64700567	Triclopyr-butotyl	0	0	0	0	0	8.17e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0359	0	0	0	0	0.726206724224826	0.520150205693433	0.283871225434351		0.00936	
C647427	3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctan-1-ol	0.007	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0148	0	0	0.000257	0	0	0	0	0.00151902178562044	1.6274837065072e-05	4.78848335066111		0.0146	
C6485401	R-(-)-Carvone	0.00195	0	0	0	0.000481	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0779	0	0	0	0	0	0	0	4.25976413546996e-07	1.41158004773311e-08	7.85029448889286		0	
C64868	Colchicine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.25684282201889e-12	3.61184545710483e-11	10.4422708404633		NA	
C648917139	AVE2865	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.879645742901064	0.535009120753065	0.271638814130243		NA	
C65236	Pyridoxine	0	0	0	0	0	6.79e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0379	0	0	0	0	5.78839104323342e-09	3.59043334049213e-08	7.44485313191555		0	
C65277421	Ketoconazole	0	0.015	0	0	0	0	0	0	0.0215	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00138	0	0	0.0626	0.454050458586592	0.0752436671246464	1.12353004654552		NA	
C654055013	Morin hydrate	0.0898	0	6.52e-06	0	0	6.7e-06	0	0.00187	0	0	0.0302	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00128	0	4.10731682042845e-12	1.29859607173344e-20	19.8865259152066	EAS hi AUC med	0.538	KNN hi AUC med
C65452	Salicylamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.76333579976105e-14	4.54546402904608e-15	14.3424217747154		0.0288	
C657841	Sodium 4-methylbenzenesulfonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.35223964279832e-07	5.70734963137339e-09	8.24356552182197		0.0123	
C65850	Benzoic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.39333064292104e-15	2.74655135604782e-19	18.5612122759655	EAS hi AUC low	0	
C6610293	N-Methylhydrazinecarbothioamide	0	0	0	0	0	0	0	0	0.000784	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0746	0	1	1	4.82163733276644e-17		0	
C66215278	Cyromazine	0	0	0	0	0	0.000998	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.094	0	0	0	0	0.999999999241105	0.9999999898351	4.41456011221503e-09		NA	
C66230044	Esfenvalerate	0	0	0	0	0	0.00129	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.15	0	0	0	0	0	1.07353853482714e-16	8.89944436935619e-15	14.0506371073838		0.00468	
C6624733	Pentane-1,5-diyl dibenzoate	0	0	0	0.0383	0	0	0	0	0	0	0	0	0	0	0	0.00166	5.68e-06	0.0037	0	0	0	0	0	0	0	0	3.79507865973939e-07	1.21450215799785e-08	7.91560170917855		0.00552	
C6625463	C.I. Acid Violet 12, disodium salt	0	0	0	0	0	0.00512	0	0	0.000615	0	0	0	0	0	0	0	0	0	0	0	0	0.00249	0	0	0	0.105	1.04736877011163e-05	8.92296242284638e-05	4.04949093594876		0	
C66273	Methyl methanesulfonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999889	0.999999848267496	6.58965942625766e-08		0	
C66332965	Flutolanil	0	0	0	0	0	0.000383	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0871	0	0	0	0	1.24927897734168e-07	1.66449933949741e-05	4.77871637284296		0	
C66357355	Ranitidine	0	0	0	0	0	0	0.000961	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.108	0	0	0.623905261572466	0.414400642918576	0.382579579479587		NA	
C66441234	Fenoxaprop-ethyl	0	2.96e-07	0	0	0	0	0	0	0.00054	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0295	0.14	0	0.372158814242346	0.147787541163621	0.83036217644157		0	
C66456539	Adipic acid, polypropyleneglycol, laurate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.211143317504668	0.0337396791267065	1.47185905198292		0	
C66575299	Forskolin	0.0528	0	0	0	0	0.0136	0	0.145	8.41e-05	0	0	0	0	0	0	0	0	0	0	0	0.000589	0.0292	0	0	0	0.00167	1.08917569771277e-07	3.32003986172068e-09	8.47885670195217		NA	
C66717	1,10-Phenanthroline	0	0.00028	0	0	0	0	0	0	0.159	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.001	0.00929	0.100327548457861	0.0130518533433531	1.88432781478995		0	
C66819	Cycloheximide	0	0.146	0	0	0	0	0	0	0.00206	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0732	0.00154221153230171	0.00424325136246133	2.37230124065939		NA	
C6683198	Irganox 1010	0.149	0	0	0	0	0	0	0.0457	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.7100746173454e-17	5.79531936500525e-19	18.2369226261995		NA	
C668981020	CP-863187	0	0.0245	6.71e-06	0	0	0	0	0	0.0188	0	0.0481	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.54e-06	0.00142195511561476	0.00169347145280106	2.77122211994965		NA	
C6706598	L-Glucitol	7.22e-05	0	0	0	0	0.127	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00267	0.00276	0	0	0	0	0.0158548201616728	7.02751490161867e-05	4.1531982248121		0	
C67209	Nitrofurantoin	1.37e-06	0	0	0	0	0.0108	0	0	0.00132	0	0	0	0	0	0	0	0	0	0	0	0	0.0122	0	0	0.067	0	0.984986356512894	0.703445558218425	0.152769508293529		0	
C6728263	(2E)-2-Hexenal	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.463381767254116	0.239403887628411	0.620868801457353		0	
C67301	Tetrac	0	0.045	0	0	0.0045	0	3.51e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0364	0.019	0	2.32679939590585e-15	3.36910963399594e-19	18.4724848564381	EAS hi AUC low	0.179	KNN hi AUC low
C6734801	Metam-sodium hydrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999573	1.85343739071581e-13		0	
C67485294	Hydramethylnon	0.2	0	0	0	0	0.0115	0	0	0.00165	0	0	0	0	0	0	0	0	0	0	0	6.78e-07	0.0277	0	0.00293	0	0	0.0141886917362775	0.110584187078918	0.956306970276796	EAS low AUC hi	NA	
C67564914	(2R,6S)-Fenpropimorph	0	0	0	0	0	0.000622	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0717	0	0	0	0	0	2.85348258944685e-06	1.72895653788126e-05	4.76221592378541		NA	
C676116044	PD 0343701	0	0.0799	0	0	0	0	0	0	0.0517	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0389	0	0.827435258796857	0.193929845270076	0.712355349050877		NA	
C67685	Dimethyl sulfoxide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999991	0.999999997942778	8.93440141136944e-10		NA	
C67747095	Prochloraz	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.654213710486305	0.225860409341897	0.646159889093864		NA	
C67786145	Acid Red 337	0	0	0	0	0	5.5e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0694	0	0	0	0	1.70718798786687e-10	1.34503421018289e-10	9.87126666948707		0	
C678397	1,1,2,2-Tetrahydroperfluoro-1-decanol	0.0146	0	0	0	0	6.3e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0629	0	0	0	0	0.00151902178562044	1.6274837065072e-05	4.78848335066111		0.007	
C6789884	Hexyl benzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.67501137664821e-06	8.62891854332209e-08	7.06404363071563		0.00964	
C68111	Thioglycolic acid	0	0	0	0	0	0.301	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00877	0	0	0	0	0.998085330064731	0.902191215769931	0.0447014057477506		NA	
C68122	N,N-Dimethylformamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		NA	
C68157608	Forchlorfenuron	0	0	0	0	0	0	0	0	0.145	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0241	0	0.999985422589901	0.946328346680656	0.0239581506912837		NA	
C68169039	2-(Dihydrocyclopentadienyloxy)ethyl methacrylate	0	0	0	7.54e-07	0	0	0	0	0	0	0	0	0	0	0	0.0358	0	0	0	0	0	0	0	0	0	0	5.56863809866615e-06	1.98392543473521e-06	5.70247465470784		NA	
C682019	Tetrapropyl orthosilicate	0	0	0	0.000395	0	0	0	0	0	0	0	0	0	0	0.11	0	0	0	0	0	0	0	0	0	0	0	0.999976531346049	0.960650084952766	0.0174347745036607		NA	
C68224	Norethindrone	0.524	0	0	0	0	0.0599	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0293	0	0	0	0	1.22072377476728e-07	2.06932932639309e-11	10.6841703874137		0.495	
C68268	Retinol	0.000138	0	0	0	0	0.226	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0131	0.00588	0	0	0	0	2.40015378226304e-13	1.2899203226039e-14	13.8894371149117		0	
C683181	Dibutyltin dichloride	0.000186	0.222	0	0	0	0.00568	0	0	0.00734	0	0	0	0	0	0	0	0	0	0	0	0	0.000331	0	0	0.263	0	0.998942675467087	0.878692497211895	0.0561630818420345		0	
C68359375	Cyfluthrin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.62066692827877e-16	1.42108711381949e-14	13.8473792986443		0.0138	
C68392358	4-Hydroxytamoxifen	0.0118	0.686	0	0	0.0142	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.123	0	0	0	0	0	0	1.86174683394228e-14	1.61494419911246e-16	15.7918424791757	EAS hi AUC med	0.0199	
C6846500	2,2,4-Trimethyl-1,3-pentanediol diisobutyrate	0.0272	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.126	0	0	0.280277775772422	0.0668868629539022	1.17465917232003		NA	
C684935	N-Nitroso-N-methylurea	0.000967	0.00336	0	4.17e-06	0	0	0	0	0	0	0	0	0	0	0	0.00371	0	0	0	0.115	0	0	0	0	0	0	1	1	1.44649119982993e-16		NA	
C68515480	DINP branched	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.472592937116e-08	2.23705044740604e-09	8.65032422207993		0	
C68515491	1,2-Benzenedicarboxylic acid, di-C9-11-branched alkyl esters, C10-rich	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.472592937116e-08	2.23705044740604e-09	8.65032422207993		0	
C68515753	Hexanedioic acid, di-C7-9-branched and linear alkyl esters	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.48048699175929	0.0906950048369531	1.04241663169941		0	
C68555862	Acid Orange 156	0	0	0	0	0	0.000215	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0904	0	0	0	0	9.2154437758281e-07	4.92510203707826e-07	6.30758476746465		0	
C68609972	C12-14-Alkyl glycidyl ether	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.247460715641764	0.0274770615552679	1.56102971333618		0	
C68694111	Triflumizole	0	0	0	0	0	0.000622	0	0	0.0707	0	0	0	0	0	0	0	0	0	0	0	0	0.1	0	0	0	0	0.997222044383464	0.934576697459766	0.0293850517846393		NA	
C68917180	Cornmint oil	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0362	0	0	0	0	0	-1	-1	0		NA	
C6893023	3,5,3'-Triiodothyronine	0.135	0	0.0238	0	0	0.026	0	0.000878	0	0	0.00201	0.0516	0	0	0	0	0	0	0	0	0.00272	0	0	0	0	0	1.48550250990996e-14	1.13989432948018e-15	14.9431354067782		NA	
C68959206	Disiquonium chloride 	0.0121	0.0019	0	4.03e-06	0.0453	0	0	0	0	0	0	0	0	0	0	0.0306	0	0	0	0.00468	0	0	0	0	0	0	0.999974701985305	0.999944622198782	2.40509394390844e-05		0.00331	
C68962	17alpha-Hydroxyprogesterone	0.343	0	0	0	0	0.000348	0	0.0157	0	0	0.0018	0	0	0	0	0	0	0	0	0	0	0.0233	0	0	0	0	1.70044281014327e-07	6.17399205000752e-11	10.2094339340765		0.524	
C69090	Chlorpromazine hydrochloride	0	0	0	0	0	0	0	0	0.0325	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0368	0	0.99991308571602	0.974824592123411	0.0110735233026824		NA	
C6915157	Malic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.681479724770172	0.199229848191983	0.700645595962585		0	
C6923224	Monocrotophos	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999991301867	0.9999999822274	7.71854201012029e-09		0	
C692864	Ethyl undec-10-enoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.245504671700334	0.0357144315306193	1.44715625818343		0.0173	
C69327760	Buprofezin	0	0.00796	0	9.23e-07	0	0	0	0	0.0509	0	0	0	0	0	0	0	0.0388	0	0	0	0	0	0	0	0.00252	0.000313	0.99999932310326	0.983757052217226	0.00711214131338877		NA	
C69377817	Fluroxypyr	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.824556723212762	0.349294739371777	0.456807955098147		0	
C695067	gamma-Caprolactone	0	0	0	0	0	0	0.000452	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0775	0	0	0.544195489010457	0.1501143638877	0.823577749737383		0	
C69655056	2',3'-Dideoxyinosine	0	0	0	0	0	0	5.67e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0645	0	0	0.999708106115183	0.983302311421701	0.00731293995257723		0.0207	
C69658	D-Mannitol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0124896012133021	6.61549162098091e-05	4.17943787629194		0	
C69727	Salicylic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.24167417131976e-16	3.271765107697e-20	19.4852178835132	EAS hi AUC low	0.0288	
C69749	Cytarabine hydrochloride	0.0289	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0783	0	0.000455	0	0	0.999997578693132	0.998835240721088	0.000506143352415756		0.0207	
C69806402	Haloxyfop-methyl	0	0.0317	0.000392	0	0	0	0	0	1.84e-05	0	0	0.117	0	0	0	0	0	0	0	0	0	0	0	0	0.00397	0	0.0118151055491826	0.00713481696879713	2.14661716346889		0.0272	
C69806504	Fluazifop-butyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.016269251264235	0.0189786578853008	1.72173450284745		0.0272	
C7011838	2(3H)-Furanone, 5-hexyldihydro-5-methyl-	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00313944301878321	0.000195871844577162	3.70802798679018		0	
C70553	4-Toluenesulfonamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.01762916636248e-06	5.75960878496624e-08	7.23960701454562		0	
C705602	(2-Nitro-1-propenyl)benzene	4.3e-05	0.0254	0	0	0.0496	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00404	0.000248	0	0	0	0	0	0	0.000209979660445204	3.69815634577072e-05	4.43201473226009		NA	
C70568604	4-Butylcyclohexanol	0	0	0	0	0	1.86e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.28e-06	0	0	0	0	1.3452944020791e-08	8.72291933385159e-11	10.0593381436912		0.248	KNN hi AUC low
C706149	gamma-Decanolactone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.146593391912135	0.0187416222307736	1.72719282031156		0	
C7080504	Chloramine-T trihydrate	0	0	0	0	0	0	0.000372	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0982	0	0	1.77663171194477e-06	6.253592795333e-08	7.20387040139457		0	
C709988	Propanil	0	0	0	0	0	0	0	0	0.000359	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0706	0.999284652686585	0.960278414370819	0.0176028333199015		NA	
C71238	1-Propanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.959689299363188	0.15321286867679	0.814704755848289		0	
C712505	Cyclohexylphenylketone	0.0191	0	0	0.000417	0	0.0458	0	0	0	0	0	0	0.000641	0	0.00279	0	0	0	0	0	0.00201	0.00261	0	0	0	0	2.01732538949229e-19	4.38378027415878e-18	17.358151221885	EAS hi AUC med	0	
C71283802	Fenoxaprop-P-ethyl	0	0.000153	0	0	0	0	0	0	0.00174	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.237	0	0.261922755775147	0.101363771484542	0.994117238846269		0	
C71526073	MON-4660	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999999128507	0.999988027240856	5.19973435713653e-06		NA	
C7173515	Didecyldimethylammonium chloride	0.00313	0.085	0	0	0	0	0	0	0	0	0	0.0235	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99967677971416	0.999441789503598	0.000242495426372772		0.0071	
C71751412	Abamectin	0	0.000773	0	0	0	0	0	0	0.136	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0645	0	3.96165065198886e-06	7.64035071613468e-07	6.11688670548372		0	
C717748	1,3,5-Triisopropylbenzene	0	0	0	0	0	0.0295	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00176	0.0112	0	0	0	0	8.58661437130027e-13	9.26594174819417e-17	16.0331104343851	EAS hi AUC low	0	
C7212444	Nerolidol	0	0	0	0	0	2.04e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0503	0	0	0	0	3.10668903783841e-06	2.5666387262282e-07	6.59063525725275		0	
C72178020	Fomesafen	0	0	0	0	0	1.13e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0727	0	0	0	0	4.44652279432602e-06	6.50666840941048e-05	4.18664132506769		0	
C72208	Endrin	0	0	0	0	0	0.225	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.87e-06	0.0305	0	0	0	0	8.74710710341029e-12	6.11875772332279e-16	15.2133367426698	EAS hi AUC low	0.0181	
C72333	Mestranol	0.742	0	0	0	0	0	0	0	0	0	0.0279	0	0	0	0	0	0	0	0	0	0	0.00155	0	0.17	0	0	1.86938896752497e-15	7.19457927385943e-24	23.1429945977501		1.06	
C72435	Methoxychlor	0.254	0	1.84e-07	1.56e-05	0	0.032	3.88e-07	0	0	0	0.00379	0	0	0	0.000571	0	0.000377	0	0	0	0.0112	0.00225	0	0.00557	0	0	2.00285169538307e-17	2.68599914640084e-22	21.5708941296842		0.568	
C72490018	Fenoxycarb	0	0.000102	0	0	0	0.0676	0	0	0.0552	0	0	0	0	0	0	0	0	0	0	0	0.0113	0	0	0	0.00983	0	0.000563523323146721	0.0004593568222084	3.33784982924963		NA	
C725228455	AVE5638	0.00507	0.00382	0	0	0	0.055	0	0	0	0	0	0	0	0	0	0.00451	0	0	0	0	0.00304	0.0743	0	0	0.0279	0	4.45014920860988e-05	0.000407363167945406	3.39001824063087		NA	
C72548	p,p'-DDD	0.0728	0	0	0	0	0.0157	4.33e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0124	4.86e-08	0	0.0083	0	0	9.64844377354761e-08	9.93492317188182e-14	13.0028354869997		0.385	KNN hi AUC med
C72559	p,p'-DDE	0.0677	0	0	0.000688	0	0	0	0	0	0	0	0	0	0	0.00165	0	0.00258	0.000592	0	0	0.0115	2.36e-07	0	0	0	0	2.08309977886866e-08	2.17551794906089e-12	11.6624373292198		0.0728	
C7287196	Prometryn	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999993531	0.999999999327086	2.92242813983434e-10		0	
C732116	Phosmet	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.437707484336935	0.260054791563495	0.584935139849486		0	
C73223	l-Tryptophan	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00351332789488706	0.00919214200910204	2.03658327486666		NA	
C732263	2,4,6-Tris(tert-butyl)phenol	0	0	0	0.0135	0	0	0	0	0	0	0	0	0	0	0.0342	0	0.00687	0	0	0	0	0	0	0	0	0	6.62475126279877e-19	5.78201910672177e-28	27.2379204775339	EAS hi AUC low	0	
C73314	Melatonin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.61105401268405e-05	0.000786147308106325	3.1044960683327		NA	
C7378996	N,N-Dimethyloctylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99796830507486	0.998488915800214	0.000656751858398342		0.0071	
C7398698	Dimethyldiallylammonium chloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		NA	
C74051802	Sethoxydim	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.02605904377743e-05	1.62184479773997e-05	4.78999070789927		0	
C74115245	Clofentezine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0159637516273483	0.0223270551599004	1.65116855467796		NA	
C741582	Bensulide	0	0.00571	0	4.69e-06	0	0	0	0	0.0367	0	0	0	0	0	0	0	0.0346	0	0	0	0	0	0	0	0	0.0265	0.91723591870768	0.85928419265544	0.0658631773913471		NA	
C742693385	SSR504734	0	0	0	0	0	0.000288	0	0	0.0324	0	0	0	0	0	0	0	0	0	0	0	0	0.0821	0	0	0.013	0	0.0259542041175225	0.00796116836383	2.09902319146724		0	
C744456	Diphenyl isophthalate	0.035	0	0	0	0	0.00251	1.64e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00014	0	0.107	0	0	3.51016027996435e-13	5.83287251164973e-16	15.2341175157853	EAS hi AUC med	0.275	KNN hi AUC med
C7487947	Mercuric chloride	0	0.00686	0	0	1.32e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00999	0	0	0	0	0	0.0189	0	0.999857719110738	0.998947289470301	0.000457427185562576		NA	
C75330755	Lovastatin	7.55e-05	0	0	0	0	0.117	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0218	0	0	0	0	0	2.58987051586045e-06	1.73660671131112e-07	6.76029852493043		0	
C753731	Dimethyltin dichloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999765139	0.999998252508529	7.58926566076711e-07		NA	
C7540514	(S)-(-)-beta-Citronellol	0	0	0	0	0	1.18e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0386	0	0	0	0	0	2.85958195752527e-05	2.90610561616713e-06	5.53668860625098		0	
C754916	PFOSA	0.024	0.029	0	0	0	0.0425	0	0	1.98e-05	0	0	0	0	0	0	0	0	0	0	0	0.00302	0.000943	0	0	0.0257	0	0.999162867964547	0.781396805746836	0.107128368449548		0	
C75503	Trimethylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		NA	
C75605	Dimethylarsinic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.998629368674336	0.58318160094122	0.234196186226002		NA	
C75649	tert-Butylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999683419925119	0.999752140250439	0.000107657464047473		NA	
C756796	Dimethyl methylphosphonate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	-1	-1	0		NA	
C75865	2-Hydroxy-2-methylpropanenitrile	0.00499	0	0	0	0	0.0433	1.41e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00059	0.00631	0	0.0101	0	0	0.18672398275648	0.0157668104117753	1.80225615452585		NA	
C75990	Dalapon	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.557521166044678	0.217232103563772	0.663075992295397		0	
C759944	EPTC	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999997575	1.05319024259745e-12		0.00391	
C760236	3,4-Dichloro-1-butene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.956559846607553	0.85373120296379	0.0686788452887078		0	
C76039	Trichloroacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.707597331432857	0.389499729690476	0.409492839388016		0	
C762049	Diethyl phosphite	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999779125457502	0.873359243117216	0.0588070790763445		NA	
C7632000	Sodium nitrite	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999988	5.35201743937078e-15		0	
C76448	Heptachlor	0	0	0	0	0	0.00109	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.178	0	0	0	0	1.96985307508443e-10	1.17966975916782e-13	12.9282395535788		0.0191	
C76493	Bornyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.83624052102227e-06	1.41477057722303e-07	6.84931398072225		0	
C76578148	Quizalofop-ethyl	0	6.1e-05	0	0	0	0	0	0	0.00152	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.224	0	0.552843678268975	0.221483131914813	0.654659343911665		0	
C7659861	2-Ethylhexyl sulfanylacetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.341055850431982	0.109543075639567	0.960415069555304		0	
C7664382	Phosphoric acid	0.0069	0	0	0.000214	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0111	0	0	0.841042626319923	0.121155213701097	0.916657892026712		NA	
C76738620	Paclobutrazol	0	0	0	0	0	0.000781	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0978	0	0	0	0	0	5.40103642914708e-10	7.71575978885446e-10	9.11262130150494		0.0268	
C7681767	Ronidazole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999989	4.86985370609413e-15		NA	
C7681825	Sodium iodide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999234787	0.999815403372741	8.01766969981094e-05		NA	
C76879	Triphenyltin hydroxide	0	0.000198	0	0	0	0	0	0	0.321	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0201	0	4.81371772060071e-08	1.98923994668367e-11	10.7013128281196		NA	
C7696120	Tetramethrin	0	0	0	0	0	0	0	0	0.00038	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0746	0	0.284855960143651	0.336540377436285	0.472962822537238		NA	
C769926	4-tert-Butylaniline	0.00506	0	0	0	0	0.0198	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0365	0	0	0.000618	0	0	6.18998501048179e-06	4.73757345355492e-07	6.32444404346687		0.0183	
C770354	1-Phenoxy-2-propanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.44444418483118e-12	6.82256493308255e-13	12.1660523222839		0	
C77065	Gibberellic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.60583629407481e-08	1.37512048127573e-09	8.86165924942575		NA	
C77098	Phenolphthalein	0.276	2.61e-07	0	0	0	0.0014	0	0	0	1.05e-08	0.0131	0.00808	0	0	0	0	0	0	0	0	8.91e-07	0	0	0	0	0	1.54722095368618e-17	3.14319814450128e-21	20.5026282405697		0.0459	
C77407	Bisphenol B	0.491	0.00196	0.0276	0.000784	0	0	2.31e-06	0	0	0	0.006	0.0251	0	0	0.00209	0.00233	0.00278	0	0	0	0.00384	0	0	0.0185	0.00135	0	2.74707617318435e-17	4.44540978444083e-28	27.3520881989416		0.45	
C7747355	5-Ethyl-1-aza-3,7-dioxabicyclo[3.3.0]octane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999649497	0.999999807819387	8.34629877173265e-08		NA	
C77474	Hexachlorocyclopentadiene	0.00973	0	0	0.00689	0	1.15e-06	0	0	0	0	0	0	0	0	0	0.00104	0	0.00208	0	0	0.12	0	0	0	0	0	0.0264125246720025	0.00284585583053663	2.54578710480982		NA	
C77485	1,3-Dibromo-5,5-dimethylhydantoin	0	0	0	0	0	0	0.000378	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0735	0	0	0.99999999999996	0.999999925422756	3.23884866281998e-08		0.00936	
C77501634	Lactofen	0	0	0	0	0	0.0297	0	0	0.000221	0	0	0	0	0	0	0	0	0	0	0	0.000241	0.00825	0	0	0.0313	0	2.43993621547918e-05	0.000136224045307388	3.86574622705892		0	
C7757791	Potassium nitrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	4.82163733276644e-17		0	
C77714	5,5-Dimethylhydantoin	0	0	0	0	0	0.0818	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0549	0	0	0	0	0.999999999996457	0.999994544236563	2.36941441875692e-06		0	
C7773060	Ammonium sulfamate	0	6.25e-05	0	0	0.000204	0	0	0	0	0	0	0	0	0	0	0	0	0	0.187	0	0	0	0	0	0	0	1	0.99999998281016	7.46545262274237e-09		0	
C77736	Dicyclopentadiene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.44760881464028e-12	1.89143389042698e-14	13.723208833607		NA	
C7775271	Sodium persulfate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999999	0.999999999643468	1.54840036244384e-10		NA	
C77781	Dimethyl sulfate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999523	0.999999713600526	1.24381728856017e-07		0	
C7779273	1,3,5-Triethylhexahydro-s-triazine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999999999979	0.999999999999988	5.15915194606012e-15		NA	
C77838	Ethyl methylphenylglycidate	0.00327	0.0102	0	0.0156	0	0	0	0	0	0	0	0	0	0.00401	0	0.0294	0	0.00246	0	0.0253	0	0	0	0	0	0	3.09009442015236e-10	1.65265263234473e-09	8.78181842029983		0	
C7785264	(-)-alpha-Pinene	0	0	0	0	0.0334	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00444	0	0	0	0	0	0	0	4.31312544839291e-11	2.26092913024539e-14	13.6457130505807		0	
C77861	Tromethamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999960621809429	0.944104952906407	0.024979723991649		0	
C7786347	Mevinphos	0	0	0	0	0	0	0.000447	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0691	0	0	0.87571730599812	0.734264261457881	0.134147609514305		NA	
C77907	Acetyl tributyl citrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.436551416782634	0.133423431734971	0.874767893211285		0	
C77929	Citric acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00704083954624687	0.00157718157046845	2.80211830634559		0	
C77930	Triethyl citrate	6.04e-05	0	0	0	0	0	0	0.272	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.209866848152696	0.0449098290324106	1.3476585982533		0	
C78079	Ethyltriethoxysilane	0	0	0	0.00112	0	0	0	0	0	0	0	0	0	0	0	0	0	0.178	0	0	0	0	0	0	0	0	0.999999824121643	0.9914228710826	0.00374106659851158		0	
C78115	Pentaerythritol tetranitrate	0	0	0	0	0	0.0346	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0121	0	0	0	0	0.999999986102103	0.999907626243743	4.01192656272198e-05		NA	
C78400	Triethyl phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999412809281	0.998596728849808	0.000609860917404859		NA	
C78422	Tris(2-ethylhexyl) phosphate	0.00568	0	0	0	0	0.000304	0	0.0174	0	0	0	0	0	0	0	0	0	0	0	0	0	0.255	0	0	0	0	0.0523545937821401	0.00840122786853362	2.07565723565739		0.0117	
C78473719	Enterolactone	0.0866	0	0	0	0	0	9.04e-06	0.00417	0	0	0.000835	0	0	0	8.3e-05	0	0	0	0	0	0	0	0	0.00539	0	0	3.23916394809892e-16	1.8647809310057e-17	16.7293721805006	EAS hi AUC med	NA	
C78488	Tribufos	3.83e-05	0	0	0	0	0.085	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0584	0	0	0	0	0.999959820839234	0.987528741342217	0.00545025567650718		NA	
C78491028	Diazolidinyl urea	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999912168	3.81448890522837e-11		0.00189	
C78513	Tris(2-butoxyethyl) phosphate	0.000118	0	0	0	0	0	0	0.239	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999687945700688	0.925409691727797	0.0336659564874492		0	
C78587050	Hexythiazox	0	0	0	0	0	0.000507	0	0	0.0595	0	0	0	0	0	0	0	0	0	0	0	0.057	0	0	0	0	0	0.668156930727811	0.12508560946524	0.902792651052589		NA	
C78591	Isophorone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.63397157109718e-08	5.08191176930486e-10	9.29397287931648		0.0185	
C78637	2,5-Dimethyl-2,5-di-(tert-butylperoxy)hexane	0.0159	0	0	0	3.34e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00596	0	0.00392	0.000548	0	0	0	0	0.0069971512767598	0.00191409193315447	2.7180372070488		NA	
C78693	3,7-Dimethyl-3-octanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.06761646736889e-06	1.51327592255717e-08	7.82008187784686		0.00239	
C78706	Linalool	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.51308245497036e-06	9.96958295381278e-08	7.00132300865385		0	
C78820	2-Methylpropanenitrile	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999994316045532	0.999346210699526	0.00028402994351275		NA	
C789026	o,p'-DDT	0.385	0	0	0	0.00148	0.00133	3.81e-08	0	0	0	0	0	0	0	0	0	0	0	0.0566	0	0.0108	0	0	0.00435	0	0	1.37682670073456e-07	8.14606228572995e-13	12.0890522735717		0.236	
C78966	1-Amino-2-propanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99991387225679	0.960085957998148	0.0176898821551546		0.0651	
C79061	Acrylamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999743393038	0.999999899170665	4.37896262016992e-08		0	
C79098207	4-Chloropentylbenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.18100800335222e-11	7.29278025912223e-13	12.1371068720929		0	
C79141	Glycolic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999169819821999	0.808310145056514	0.0924219703609033		0.00766	
C79163	N-Methylacetamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999999347	2.83801573406725e-13		0	
C79241466	Fluazifop-P-butyl	0.0272	0	0	0	0	0	0	0.0579	0	0	0	0	0	0	0	0	0	0	1.8e-05	0	0	0	0	0	0	0	0.0109290693293604	0.0119202520981794	1.92371455972242		0	
C79243	Nitroethane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	4.82163733276644e-17		NA	
C79277273	Thifensulfuron-methyl	0	0	0	0	0	0.000509	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0933	0	0	0	0	0.906059847839005	0.71569003343344	0.145275030648289		0	
C79390	Methacrylamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999990389600625	0.999980873861067	8.30645603397445e-06		0	
C79436	Dichloroacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.934477790966767	0.573115484331853	0.241757857692949		0	
C79447	Dimethylcarbamoyl chloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		NA	
C79538322	Tefluthrin	0	0	0	0	0	0.000677	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0759	0	0	0	0	0	3.52927776359816e-11	2.68082400313794e-10	9.57173169663814		0	
C79572	Oxytetracycline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.94297130755947e-13	1.02368364092254e-13	12.9898342369436		0	
C79622596	Fluazinam	0	0.00891	0	0	0	0	3.98e-08	0	0.00667	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0117	0	0.0263	0	0.951471702083636	0.504526418023065	0.297116088294752		NA	
C797637	Norgestrel	0.394	0	0	0	0	0.0514	5.2e-05	0.0311	0	0	0	0	0	0	0	0	0	0	0	0	0.00373	0.00202	0	0.00741	0	0	1.27717740735748e-07	4.66091903631712e-11	10.331528441025		0.524	
C79902639	Simvastatin	7.11e-05	0	0	0	0	0.000492	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.198	0	0	0	0	7.29115541998685e-07	2.44643027798167e-08	7.61146715689947		0	
C79925	2,2-Dimethyl-3-methylenebicyclo[2.2.1]heptane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.34438303336507e-11	1.10051388486294e-14	13.9584044737092		0	
C79947	3,3',5,5'-Tetrabromobisphenol A	0	3.81e-07	0	0	0	0.000607	0	0	2.47e-05	0	0	0	0	0	0	0	0	0	0	0	0.0252	0	0	0	0.0807	0	1.38772039935108e-18	4.17080203133131e-28	27.379780423614	EAS hi AUC low	0.45	KNN hi AUC low
C79958	2,2',6,6'-Tetrachlorobisphenol A	0.19	0	0.0187	0	0	0.0381	0	0.00116	0	0	0.0193	0.011	0	0	0	0	0	0	0	0	0.00516	4.21e-07	0	0	0	0	2.87204042303781e-18	3.90703635022082e-26	25.4081525481745		0.45	
C79983714	Hexaconazole	0.000168	0.00822	0	0	0	0.0774	0	0	0.0127	0	0	0	0	0	0	0	0	0	0	0	0.00119	0.0489	0	0	0	0	4.43367747087559e-11	1.93288587518301e-11	10.7137937875863		0.0268	
C8000348	Clove leaf oil	5.49e-05	0	0	0	0	0.000519	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.143	0	0	0	0	0	-1	-1	0		NA	
C8000417	Terpineol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.64682889666003e-10	3.32864097001545e-13	12.4777330456814		0	
C8001545	Benzalkonium chloride	0	0.0727	0.000515	0	0	0	0	0	0.0244	0	0	0.121	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0830597093129894	0.152527807654799	0.816650971988656		0.0312	
C8004920	C.I. Acid Yellow 3 disodium salt	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0156264922090721	0.00679947179845686	2.16752482316513		NA	
C80057	Bisphenol A	0.45	0	0.00511	0	0	0.00956	5.76e-08	0.000423	0	0	0.00145	0.00535	0	0	0.000204	1.07e-05	0	0	0	0	0.0337	0	0	0.00595	0	0	5.37954845865076e-17	8.9692867372741e-28	27.0472420918926		0.552	
C8006904	Peppermint oil	0.00851	0	0	0	0	4.85e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0165	0	0	0.0813	0	0	2.43830193660895e-11	2.18576488770137e-12	11.660396554859		NA	
C8007703	Anise oil	0.0384	0.00206	3.79e-06	0.0172	0	0	1.64e-06	0	0	0	0.0302	0	0	0	0	0	0	0	0	0	0	0	0	0.00948	0	0	-1	-1	0		NA	
C80079	4,4'-Dichlorodiphenyl sulfone	0	0	0	0	0	0	0	0	0.000474	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.103	0.00303786822105983	0.000259344358064591	3.58612319547478		NA	
C80080	Dapsone	0.00158	0	0	0	0	0	3.28e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00114	0	0.0677	0	0	0.789070148177974	0.313033216892241	0.504409575720035		NA	
C80091	4,4'-Sulfonyldiphenol	0.263	0	1.9e-05	0	0	0	5.62e-05	0.000476	0	0	0.00969	0	0	0	0	0	0	0	0	0	0.00245	0	0	0.0351	0	0	1.89611354969708e-13	1.46402855499804e-16	15.8344504525419		NA	
C80159	Cumene hydroperoxide	0	0	0	0	0	4.84e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0473	0	0	0	0	0	2.50899073690284e-16	3.86550443894231e-23	22.4127938236721	EAS hi AUC low	0.216	KNN hi AUC low
C8018017	Mancozeb	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	1	0		0	
C80262	alpha-Terpinyl acetate	0.00943	0	0	0	0	0.0381	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0162	0	0.00109	0	0	9.99189377918894e-05	7.39110856299579e-06	5.13129041861664		0	
C80273	Terpinyl propionate	0	0	0	0	0	0.0332	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0278	0	0	0	0	0	0.000604636919429682	6.02257083863277e-05	4.22021808304462		0.00943	
C80433	Dicumyl peroxide	0.216	0	0	0.000469	0.00265	0.0114	7.84e-05	0	0	0	0	0	0.000184	0	0.000415	0	0.0019	0	0.00403	0	0.0121	4.57e-08	0	0.00383	0	0	3.10089629411083e-17	2.7922097748898e-21	20.5540519568745		0	KNN low AUC hi
C80466	4-(2-Methylbutan-2-yl)phenol	0.282	0.000192	0	0.00179	0	8.34e-06	0	0	0	0	0	0	0	0	0.00146	0	0.00911	0	0.0305	0	0.0185	0	0	3.04e-05	0	0	3.74072143136798e-17	8.8652107503997e-28	27.0523109355681		0.491	
C80546	3-(4-tert-Butylphenyl)-2-methylpropanal	0.0022	0	0	0	0	0.098	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0259	0	0	0	0	0	1.38392141943094e-20	7.18488686884156e-21	20.1435800657517	EAS hi AUC med	NA	
C80568	alpha-Pinene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.17589296611306e-10	2.18530147442424e-13	12.6604886412348		0	
C80844071	Etofenprox	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.86838639888182e-17	2.65043036418158e-21	20.5766836016805	EAS hi AUC low	NA	
C81072	Saccharin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0695159560331805	0.0375124195857006	1.42582492255073		0.0257	
C81131706	Pravastatin sodium	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.40496549943791e-07	4.96483133912699e-08	7.30409550038725		0	
C81334341	Imazapyr	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.251160698457354	0.0646867403999646	1.18918473264333		0	
C81335377	Imazaquin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0053444126476713	0.00424985005750585	2.37162639238417		0	
C81335775	Imazethapyr	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.101360395008865	0.0288482432450218	1.53988062868583		0	
C81405858	Imazmethabenz	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.9238224711894e-05	0.00049994813548926	3.30107504694223		NA	
C81406373	Fluroxypyr-meptyl	0.00936	0	0	0	0	2.26e-06	6.4e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0074	0	0.114	0	0	0.391529493066685	0.309352829271958	0.509545907665379		0	
C81741288	Tributyltetradecylphosphonium chloride	0.093	0.0244	0	0	0	0	0	0.246	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.488828289239493	0.087978028551967	1.0556257741004		0	
C81777891	Clomazone	0	0	0	0	0	0.053	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00551	0.0106	0	0	0	0	0.800907762418538	0.57482236824559	0.240466340369724		NA	
C81812	Warfarin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.75365074556394e-18	2.74461463979335e-22	21.5615186244598	EAS hi AUC low	0	
C818611	2-Hydroxyethyl acrylate	0	0	0	0	0	0	0.0689	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.063	0	0	0.980630022714203	0.74948235338316	0.125238588190672		NA	
C81889	Rhodamine B	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0345	0	1.07003282431774e-07	2.29055805099362e-06	5.64005869716154		0	
C81903	Phenolphthalin	0.0459	0	0	0	0	0.0224	0	0	0	0	0.0783	0	0	0	0	0	0	0	0	0	0.00897	0	0	0	0	0	1.15351687513867e-20	5.85586392769871e-25	24.232409023503	EAS hi AUC med	0.276	KNN hi AUC med
C822060	1,6-Diisocyanatohexane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999944751203	0.999999996517426	1.51246248380717e-09		NA	
C82385420	Sodium saccharin hydrate	0.0257	0	0	0	0	0	1.28e-05	0.0685	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000115	0	0	0.128655845716558	0.0622809791803876	1.20564456808054		0	
C824395	Sodium 2-nitrophenolate	0	0	0	0	0	0.00046	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0588	0	0	0	0	3.64031990905379e-06	1.30405529291463e-07	6.88470399380455		0	
C82469792	Butyryl trihexyl citrate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.259510836461009	0.0542644834969752	1.26548432635854		0	
C824782	Sodium 4-nitrophenolate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.32616683269333e-07	9.3112573980551e-09	8.03099166765844		0	
C82558507	Isoxaben	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.78503701012503e-07	1.37175989284694e-05	4.86272189907915		NA	
C82640048	Raloxifene hydrochloride	0.0243	0.671	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0252	0	0	0	0	0	0	3.07961346167034e-11	9.42827987942065e-11	10.0255675338817		NA	
C82657043	Bifenthrin	6.93e-05	0	0	0	0	0.062	0	0	0.000342	0	0	0	0	0	0	0	0	0	0	0	0.0143	0.00446	0	0	0	0.0148	1.11174859709524e-12	6.24373131254442e-12	11.2045557942691		0	
C826620	3a,4,7,7a-Tetrahydro-4,7-methanoisobenzofuran-1,3-dione	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000189933090959541	1.51315621624824e-05	4.82011623367383		NA	
C82688	Pentachloronitrobenzene	0.00362	0	0	0	0	0.0473	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0401	0	0	0	0	0.917737937873862	0.410663971193098	0.386513397458963		0	
C827190	Sodium 2,5-dimethylbenzenesulfonate	0.000157	0	0	0	0	0	0.771	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.109	0	0	4.49366607048792e-07	8.95630642708596e-09	8.04787105608051		0.0123	
C827214	Benzenesulfonic acid, 2,4-dimethyl-, sodium salt	0.0123	0.0365	0	0.00559	0	0	0	0	0	0	0	0	0	0	0	0.00329	0.000154	0.0401	0	0	0	0	0	0	0	0	5.77673016466221e-08	1.15699266280536e-09	8.93666939516515		0	
C828002	Dimethoxane	0	0	0	0	0	6.9e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0336	0	0	0	0	0.94965548265525	0.539987221902084	0.267616517071613		NA	
C83329	Acenaphthene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.2662739353529e-20	1.54245875082837e-22	21.8117864412507	EAS hi AUC low	0.012	
C83410	1,2-Dimethyl-3-nitrobenzene	0	0	0	0	0	0.0327	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0161	0.0202	0	0	0	0	0.0337575946440161	0.0029200864634224	2.53460428895182		0	
C834128	Ametryn	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999998374	0.999999999999871	5.59309930600943e-14		0	
C83657243	Diniconazole	0	0.00761	0	0	0	0	0	0	0.0165	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00116	0.00296	7.9877663389032e-08	3.00201290261596e-06	5.52258744549619		0	
C83670	Theobromine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999995195169703	0.93913848575341	0.0272703617659335		0	
C83794	Rotenone	0.000414	0.000154	0	0	0	0	0	0.739	0.0113	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.54780485159799e-15	1.20182830573973e-16	15.9201575715977	EAS hi AUC med	NA	
C83834597	2-Ethylhexyl trans-4-methoxycinnamate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.0951202022361e-11	3.17655429244554e-12	11.4980437174709		0.37	KNN hi AUC low
C83885	Riboflavin	0	0	0	0	0	0	0	0	0.000282	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0128	0.0747	0	0.157903310339699	0.0187960923993587	1.72593242870373		NA	
C838857	Diphenyl phosphate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.23628566098772e-12	2.06891769383618e-17	16.6842567861945	EAS hi AUC low	0.142	KNN hi AUC low
C838880	4,4'-Methylenebis(2-methylaniline)	0.0458	0.0113	9.9e-06	0.000935	0	0	0	0	0	0	0.0208	0	0	0	0	0	0	0	0	0	0.0204	0	0	0	0	0	0.00416468698732385	9.69211459451643e-05	4.01358145963235		0.143	KNN hi AUC med
C84087014	Quinclorac	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.68499612680665e-06	3.73115045718069e-05	4.4281572378512		0	
C84162	meso-Hexestrol	0.993	0	0	0	0	0.0191	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00243	0	0	0	0	1.6572863318506e-18	3.1475474106788e-28	27.5020277195073		0.943	
C842079	C.I. Solvent Yellow 14	0.117	0	0	0	0	0.000829	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0225	5.31e-08	0	0	0	0	1.69025993129096e-15	1.84788223673989e-16	15.7333257092867		0	KNN low AUC hi
C84371653	Mifepristone	0.00255	0.308	0	0.022	0	0	0	0	8.05e-06	0	0.00202	0	0	0	0.0028	0.0017	0.0197	0.0148	7.63e-06	0	0	0	0	0	0.00559	0	7.14029667701961e-08	5.41393289437351e-08	7.2664871316065		0.524	KNN hi AUC med
C84617	Dicyclohexyl phthalate	0.0199	0.0213	0	0.00322	0	0.00606	0	0	0	0	0	0	0.000179	0	0.000564	0	0	0	6.42e-05	0	0.0219	0	0	0	0.0101	0	2.46266860594384e-10	5.00490942329752e-12	11.3006037777887		0.0125	
C84662	Diethyl phthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.14062556860405e-08	5.11336386072773e-11	10.2912933023089		0.0283	
C84695	Diisobutyl phthalate	0.0283	0.0375	0	0.00239	0	0	0	0	0	0	0	0	0.000658	0	0.00669	0.000482	0.00468	0	0.0275	0	0	0.000435	0	0	0	0	1.55173504789862e-08	3.3808504166151e-10	9.4709740438677		0.014	
C84742	Dibutyl phthalate	0.0265	0.0509	0	0.00573	0.0181	0	0	0	0	0	0	0	0.000479	0	0.00883	0.000499	0.00217	0.00144	0.00324	4.58e-05	0	0	0	0	0	0	4.54403760348001e-07	3.27077681816495e-09	8.4853490889983		0.179	KNN hi AUC med
C84753	Dihexyl phthalate	0.00964	0	0	0.00554	0	0.0482	0	0	0	0	0	0	0	0	0.00441	0	0.00268	0	0	0	0.0144	0	0	0	0	0	5.853391981433e-07	1.00430688543742e-08	7.99813355981347		0.0265	
C84852153	4-Nonylphenol, branched	0.435	3.92e-07	0	0	0.0203	2.34e-05	0	0.0126	0	0	2.33e-05	0.00463	0	0	0	0	0	0	0.0247	0	0.00129	2.24e-05	0	0.00485	0	0	5.53797285508421e-17	3.90902302722769e-25	24.4079317712233		0.41	
C85018	Phenanthrene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0499	0	0	0	0	0	0	0	0	0	0	0	4.38971557697864e-15	1.26827672027868e-18	17.8967859791211	EAS hi AUC low	0.0372	
C851916422	MK-812	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.812573652025437	0.563937148694938	0.248769295832248		NA	
C85264331	(3,5-Dimethyl-1H-pyrazol-1-yl)methanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999365944933	0.999833432363143	7.2345430921706e-05		NA	
C85405	1,2,3,6-Tetrahydrophthalimide	0	0	0	1.14e-06	0	0	0	0	0	0	0	0	0	0.044	0	0	0	0	0	0	0	0	0	0	0	0	0.700120881641912	0.567311988930959	0.246178038449148		0	
C85416	Phthalimide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00120312869272306	0.00427464815844585	2.36909962576243		0	
C85507795	Phthalic acid, diundecyl ester, branched and linear	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.23740153966194e-07	8.43616540697842e-09	8.07385491368436		0.0125	
C85509199	Flusilazole	0	0.000202	0	0	0	0.000128	0	0	0.0593	0	0	0	0	0	0	0	0	0	0	0	0.0374	0	0	0	0	0.00291	0.809688387084534	0.490000598154292	0.309803389818528		NA	
C85532758	PK 11195	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.889479288619525	0.287494973568396	0.54136974391554		NA	
C85687	Butyl benzyl phthalate	0.179	0	0	0.00106	0.009	0	1.89e-05	0.039	0	0	0	0	0.0013	0	0.00105	0.000742	0	0	0.00351	0	0.00089	0	0	0.00938	0	0	1.6754478392589e-07	5.82181786463315e-09	8.23494138557225		0.0265	
C860220	C.I. Acid Blue 74	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.413277438901027	0.100338701404236	0.998531523964278		NA	
C862243296	AVE9423	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.73543712006537e-05	0.000147756371002891	3.8304537840051		0	
C86306	N-Nitrosodiphenylamine	0.0102	0	0	0	0	0.0671	0	0	0	0	0	0	0	0	7.87e-05	0	1.91e-05	0	0	0	0.0267	1.29e-08	0	0	0	0	0.978929027563928	0.719559879939796	0.142933059343299		0.028	
C86386734	Fluconazole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.90717781443566e-12	8.90515894480689e-11	10.050358324574		0	
C864283487	GSK232420A	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.878779571081536	0.572701385721708	0.242071766056283		NA	
C86479063	Hexaflumuron	1.42e-21	0	0	0	0	0	0.000856	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.214	0	0	0.000189940750704638	0.000938235751335699	3.02768802234602		0	
C86500	Azinphos-methyl	0	0	0	0	0	0.000583	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0671	0	0	0	0	0.0105	0.538888958601818	0.157685669054639	0.802207774859451		NA	
C86737	Fluorene	0	0	0	0	0	0.0261	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0223	0	0	0	0	0	3.67593097014492e-16	1.08343919680557e-19	18.9651954565018	EAS hi AUC low	0.012	
C86873	1-Naphthaleneacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.02112520421939e-21	2.14589328671609e-20	19.6683918788951	EAS hi AUC low	0	
C868859	Dimethyl hydrogen phosphite	0.0148	0.0437	0	0.015	0	0	0	0	0	0	0	0	0	3.33e-06	0	0.00848	0.00122	0.0249	0	0.0148	0	0	0	0	0	0	-1	-1	0		NA	
C87014	7-(Dimethylamino)-4-methylcoumarin	0	0	0	0	0	0	0.00182	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.108	0	0	0	1.42204148086891e-08	6.4195665075488e-07	6.19249429743516		NA	
C87183	4-tert-Butylphenyl salicylate	0.0488	0	0	0	0	0.0204	7.34e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0142	0.000605	0	0.00423	0	0	2.16135422280547e-18	7.67775856482195e-22	21.1147655488498	EAS hi AUC med	0	
C87241	Ethyl 2-methylbenzoate	0	2.85e-10	0	0.000584	0	0	0	0	0	0	0	0	0	0	0	0	0	0.115	0	0	0	0	0	0	0	0	2.46697549190181e-09	2.37013734631655e-11	10.6252264864713		0.014	
C872504	N-Methyl-2-pyrrolidone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999343	0.999999967101935	1.4287448447919e-08		0	
C87252	Ethyl anthranilate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000544410064920362	0.00132882892794075	2.87653092608022		0	
C87392129	S-Metolachlor	0	0	0	0	0	0.000509	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.138	0	0	0	0	0	0.990251965935413	0.888765728573055	0.0512127004427198		0	
C87546187	Flumiclorac-pentyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.122682844891533	0.120314246260667	0.919682945344451		NA	
C87616	1,2,3-Trichlorobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.63290592513068e-05	2.68185161430251e-07	6.57156525514675		0.00153	
C87627	2,6-Dimethylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0127572300786355	0.00045632646392286	3.34072434428367		0.139	KNN hi AUC low
C87674688	Dimethenamid	0	0.000109	0	0	0	0	0	0	0.00251	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.158	0	0.999999999929715	0.999999739606946	1.13087281205153e-07		0	
C87683	Hexachloro-1,3-butadiene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.810674699753088	0.898544597014148	0.0464603628994715		NA	
C87694	L-Tartaric acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.3558299892941	0.0733706388166247	1.13447769963414		0	
C877247	Monopotassium phthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.55002815244708e-16	2.13906241383943e-19	18.6697765433431	EAS hi AUC low	0	
C87818313	Cinmethylin	0.0107	0	0	0.000513	0	0.0979	0	0	0	0	0	0	0	0	0.00342	0	0.00185	0	0	0	0.0136	0.0022	0	0	0	0	5.94722990949433e-15	5.1284414001895e-16	15.2900146025577	EAS hi AUC med	NA	
C87820880	Tralkoxydim	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.41373288340075e-14	9.02827378780901e-15	14.0443952791543		NA	
C87865	Pentachlorophenol	0	0.000165	0	0	0	0	0	0	0.000428	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0945	0	9.90901338285192e-15	7.44640018825483e-19	18.1280536274138	EAS hi AUC low	0.00613	
C87901	Symclosene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999987097628053	0.997312627272535	0.00116868219297751		0	
C88040	4-Chloro-3,5-dimethylphenol	0.0439	0	0	0	0	0.00289	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.133	0	0	0	0	0	2.75000816140652e-18	5.30168959187968e-23	22.2755857033249	EAS hi AUC med	0.138	KNN hi AUC med
C88062	2,4,6-Trichlorophenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0367	0	0	0	0	0	1.10434591106228e-14	5.17571109465154e-19	18.2860299737421	EAS hi AUC low	0.00613	
C88120	N-Vinyl-2-pyrrolidone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999677	0.999999985924326	6.11298752458311e-09		0	
C88186	2-tert-Butylphenol	0.00325	0	0	0	0	0.000139	0	0	0	0	0	0	0	0	0	0	0.00169	0	0	0	0.143	0	0	0	0	0	2.06242284270237e-18	1.23176620574829e-26	25.9094717152144	EAS hi AUC med	0.0402	
C88244	2,2'-Methylenebis(ethyl-6-tert-butylphenol)	0	0.000115	0	0	0	0	0	0	0.108	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0285	0	9.55756307027088e-20	1.84263307457344e-28	27.7345611376801	EAS hi AUC low	0.0193	
C88302	3-Trifluoromethyl-4-nitrophenol	0.00604	0.0311	0	0	0	0.0374	0	0	0	0	0.0299	0	0	0	0	0	0	0	0	0	0.00851	4.82e-07	0	0	0	0.00138	3.14892547887681e-12	2.62080661013802e-13	12.5815650245508		0	
C88415	2-tert-Butylcyclohexyl acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	8.08392291825527e-06	6.82355950649349e-07	6.16598901672826		0.00943	
C88584	2,5-Di-tert-butylbenzene-1,4-diol	0	3.43e-05	0	0	0	0	0	0	0.0885	0	0	0	0	0	0	0	0	0	0	0	0	0.00255	0	0	0	0.0159	1.47896081923751e-19	4.23672145439436e-27	26.3729700879924	EAS hi AUC low	0.0402	
C88608	2-tert-Butyl-5-methylphenol	0.0402	0	0	0	0	0.0166	2.02e-05	0	0	0	0	0	0	0	1.72e-05	0	0	0	0	0	0.0107	0.00603	0	0.00693	0	0	1.93427657907617e-19	4.27538663228296e-27	26.3690246049886	EAS hi AUC med	0.0248	
C88671890	Myclobutanil	0	0	0	0	0	0.0582	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00147	0.0518	0	0	0	0	0.000145071246971152	0.000123548928045557	3.90816101833895		0	
C88697	2-Isopropylphenol	0	0	0	0	0	2.03e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0181	0	0	0	0	0	1.97027560477657e-18	5.88148225366873e-25	24.2305132090488	EAS hi AUC low	0.00783	
C88722	2-Nitrotoluene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.156087095456789	0.0183165690265514	1.73715587304712		0.0121	
C88744	2-Nitroaniline	0	0	0	0	0	1.1e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0449	0	0	0	0	0.86700334690291	0.437829960112679	0.358694523566571		0	
C88755	2-Nitrophenol	0	4.99e-05	0.00211	0	0	0	0	0	0	0	0	0.22	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.92354237639918e-08	2.85961972006372e-10	9.54369171668169		0	
C88857	Dinoseb	0	0.000112	0	0	0	0.00053	0	0	0.162	0	0	0	0	0	0	0	0	0	0	0	0.125	0	0	0	0	0	1.46959374792778e-14	9.92564810312643e-16	15.0032411260337	EAS hi AUC low	0	
C89043	Trioctyl trimellitate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.02134198097734e-08	5.72320739310285e-10	9.24236051618349		0.115	KNN hi AUC low
C89714	Methyl 2-methylbenzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.12961104837811e-12	6.19699361581206e-15	14.2078189512634		0	
C89725	2-(Butan-2-yl)phenol	0	0	0	0	0	0.0255	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0997	0	0	0	0	0	2.01955405364159e-18	1.51185629077158e-25	24.820489488657	EAS hi AUC low	0.163	KNN hi AUC low
C89781	dl-Menthol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.11352413782502e-09	5.44053469720575e-13	12.2643584156264		0	
C89838	Thymol	0.00465	0	0	0	0	2.69e-06	0	0	0	0	0	0	0	0	0	0	0.0151	0	0	0	0.0297	0	0	0	0	0	2.29502841698649e-19	2.0748607110242e-25	24.6830110529105	EAS hi AUC med	0.0402	
C89872	1,3-Dimethyl-4-nitrobenzene	0.0121	0	0	0	0	0	8.21e-05	0.0504	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00173	0	0	0.0757776018068208	0.00773484674357462	2.11154828688759		0	
C90006	2-Ethylphenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.594963338215e-17	5.08257762726894e-24	23.293915979569	EAS hi AUC low	0.0303	
C90028	Salicylaldehyde	0.0288	0	0	0	0	1.15e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0147	0	0.000744	0	0	7.24769636790035e-18	3.04290226775578e-22	21.5167119961321	EAS hi AUC med	0.0157	
C9003116	Pluronic F-127	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.993063613210524	0.368024356315112	0.434123438219911		0	
C90040	2-Anisidine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.42997321863643e-06	5.93093387097993e-07	6.22687691825778		0	
C9004824	Sodium lauryl polyoxyethylene ether sulfate	0.00534	0.0892	5.41e-05	0	0.0172	0	0	0	0	0	0.000972	9.61e-07	0	0	0	0	0	0	0	0.0115	0	0	0	0	0	0	0.812796046261669	0.32741579016695	0.484900379850733		0.093	
C9004960	Polyoxyethylene monoleate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.116361584630733	0.0132033092717835	1.87931720376762		0	
C90051	2-Methoxyphenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.84244259044495e-13	1.90129149350135e-15	14.7209512948577		0.0155	
C9005656	Polysorbate 80	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0416431800929745	0.00658697021572747	2.18131430030138		0	
C90120	1-Methylnaphthalene	0	0	0	0	0	3.6e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0288	0	0	0	0	4.3174899789286e-14	2.5429807980816e-18	17.5946569191474	EAS hi AUC low	0	
C90153	1-Naphthol	0.0232	0	0	0.0139	0	0.0223	0	0	0	0	0	0	0	0	0	0	0.00216	0.00106	0	0	0.0154	7.82e-05	0	0	0	0	1.384998222396e-18	1.84040401513862e-24	23.7350868279226	EAS hi AUC med	0.0874	
C9016006	Polydimethylsiloxane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999994	0.999999966450296	1.45704516158022e-08		NA	
C9016879	Isocyanic acid, polymethylenepolyphenylene ester	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0031259321305925	0.00116737408487487	2.93278995204074		0.00885	
C90302	N-Phenyl-1-naphthylamine	0.0386	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0255	0	0	0.00233	0	0	0.0144849089833141	0.00177213541234714	2.75150309588676		0	
C90357065	Bicalutamide	0.00307	0.107	0.0123	0	0	0	0	0	0	0	0	0.276	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.393506183212872	0.140538909622058	0.852203420280516		NA	
C90437	2-Phenylphenol	0.00543	0	0	8.01e-05	0	0.076	0	0	0	0	0	0	0	0	0.000397	0	0.000103	0	0	0	0.00219	0.00173	0	0	0	0	5.38457212668956e-18	4.7517131420457e-24	23.3231497853221	EAS hi AUC med	0.219	KNN hi AUC med
C90722	2,4,6-Tris(dimethylaminomethyl)phenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.08823230734014e-15	5.85140092283781e-17	16.2327401441366	EAS hi AUC low	0	
C90823384	Denatonium saccharide	0	4.01e-07	0	0.0186	0	0	0	0	0	0	0	0	0	0	0	0.0078	0	0.0752	0	0	0	0	0	0	0	0	0.994739654517185	0.656886533237157	0.182509641467211		0	
C90948	Michler's ketone	0	1.41e-07	0	0	0	0	0	0	0.000509	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.162	0	0.00306038886956657	0.00217579749278087	2.66238152802738		NA	
C91082176	C10-21 sulfonic acids phenyl esters	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.88798608765975e-12	6.68055364906106e-14	13.1751875439963		NA	
C91203	Naphthalene	0	0	0	0	0	0.000507	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0653	0	0	0	0	0	8.79335739123554e-13	4.30576464420306e-17	16.3659497126726	EAS hi AUC low	0.0112	
C91225	Quinoline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.137782441514684	0.0178475330330998	1.74842180555485		0	
C91465086	lambda-Cyhalothrin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.6153656913533e-16	2.96123527492016e-15	14.5285270858426		0.0138	
C91532	Ethoxyquin	0.000107	0	0	0	0	0.0851	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.083	0	0	0	0	0	1.05997788919436e-10	9.14328091836192e-09	8.03889793675401		NA	
C91598	2-Naphthylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00135977204824078	3.19952827446286e-05	4.49491404758617		0.0386	
C91623	6-Methylquinoline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.062061664716229	0.0107953335630737	1.9667639339352		0	
C91645	Coumarin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.13727971422099e-14	4.8793676730706e-19	18.3116364554337	EAS hi AUC low	0.134	KNN hi AUC low
C91667	N,N-Diethylaniline	0	0	0	0	0	0	7.62e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0402	0	0	0.997581718675712	0.972772366372593	0.0119887749364253		0	
C919302	3-Aminopropyltriethoxysilane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999976524484	0.999997552750962	1.0628280535379e-06		NA	
C92046	2-Chloro-4-phenylphenol	0.138	0	0	0	0	0.00583	0	0.0169	0	0	0	0	0	0	0	0	0	0	0	0	0.000637	0.00252	0	0	0	0	1.60563198479782e-18	1.48541470089464e-23	22.8281522822611		0.219	
C924163	N-Nitrosodibutylamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999166628	0.999999999675537	1.40912302856586e-10		0.00171	
C92524	Biphenyl	0	0	0	0	0	0.0321	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00155	0	0	0	0	5.12549936048811e-11	3.57638373585102e-16	15.4465558888075	EAS hi AUC low	0.383	KNN hi AUC low
C92682	4-Cyclohexylcyclohexanone	0.0491	0	0	0	0	1.27e-05	0	0.0632	0	0	0	0	0	0	0	0	0	0	0	0	3.35e-05	0	0	0	0	0	1.45818708952391e-07	6.74360217431778e-10	9.17110805798513		0.0437	
C92693	4-Phenylphenol	0.219	8.63e-08	2.68e-05	0	0	0.0095	0	0.000881	0	0	0.0507	0	0	0	0.000945	0	0	0	0	0	0	0.00636	0	0	0	0	9.72406814917614e-18	5.34086760477336e-25	24.2723881876607		0.319	
C92842	Phenothiazine	0.0122	0	0	0	0	0.0793	3.18e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00689	0.00434	0	0.00447	0	0	0.947133273287559	0.587797189957505	0.230772494460865		NA	
C92875	Benzidine	0.0183	0	0	0	0	0.0968	4.76e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0132	4.28e-05	0	0.0439	0	0	0.000795445354942764	1.0437884245259e-05	4.9813875237216		0.139	KNN hi AUC med
C928961	(Z)-3-Hexen-1-ol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.412670579727761	0.0184771296185419	1.73336549456888		0	
C929601092	SR58611	0	0	0	0	0	0.000366	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0804	0	0	0	0	0	4.73598677344005e-10	2.70616683200969e-09	8.56764543316788		NA	
C930552	N-Nitrosopyrrolidine	0.00171	0	0	0.0131	0	0	0	0	0	0	0	0	0	0.0374	0	0	0	0.00155	0	0	0	3.27e-05	0	0	0	0	1	1	0		0	
C93083	2'-Acetonaphthone	0.00257	0	0	0	0	1.14e-05	0	0	0	0	0	0	0	0	0	0.000377	0	0	0	0	0.123	0	0	0	0	0	3.03332264116949e-23	1.98387119647138e-20	19.7024865279871	EAS hi AUC med	0	
C93152	Methyleugenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.97779796198261e-17	1.357163283168e-20	19.8673678983146	EAS hi AUC low	0.0124	
C93561	Styrene glycol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.93638584078272e-17	1.40041030654556e-18	17.8537447016349	EAS hi AUC low	NA	
C93652	Mecoprop	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.86253457528e-14	4.65670453520317e-14	13.3319213168883		0	
C93765	2,4,5-Trichlorophenoxyacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.4554890350819e-09	2.0389530771758e-10	9.69059276861034		0	
C938169	tert-Butyl phenyl ketone	0	0	0	0	0	0	0.000676	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0822	0	0	5.55001234893323e-23	6.77046048668376e-22	21.1693817921679	EAS hi AUC low	0	
C93890	Ethyl benzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.69620700587912e-08	1.30490653953397e-09	8.88442059240094		0.00552	
C93925	Benzenemethanol, alpha-methyl-, acetate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.2579465085824e-12	7.84259188495364e-12	11.1055403843427		0	
C93992	Phenyl benzoate	0	0	0	1.74e-06	0	0	0	0	0	0	0	0	0	0	0.0532	0	0	0	0	0	0	0	0	0	0	0	7.93120966689797e-13	1.5058107528551e-15	14.8222296059276		0.275	KNN hi AUC low
C94086	Ethyl 4-methylbenzoate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.9291059044007e-09	9.76390458143374e-11	10.0103764734129		0	
C94097	Benzocaine	0	9.69e-08	0	0	0	0	0	0	5.67e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0492	0.0111	0	0.0002122749502426	0.000483782381449217	3.31534995196982		0	
C94133	Propylparaben	0.205	0	1.43e-05	0.00203	0	0.0147	0	0.00252	0	0	0.0161	0	0	0	0.000121	0.000286	0.00211	0.000668	0	0	0.0168	2.64e-08	0	0.000135	0	0	7.29081453439013e-12	1.5131312672592e-15	14.8201233944002		0.251	
C941695	1-Phenyl-1H-pyrrole-2,5-dione	0	0.0288	0	0	0	0	0	0	0.0106	0	0	0	0	0	0	0	0	0	0	0.00535	0	0	0	0	0.00819	0	0.999710824756191	0.93231085982679	0.030439256961844		NA	
C94188	Benzylparaben	0.234	0.000859	0.0576	0	0	0	0	0	0	0	0.0466	2.36e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.72829812209662e-13	9.76636875464924e-17	16.0102668818248		0.275	
C94268	Butylparaben	0.251	5.16e-07	0.0182	0	0	0.0107	0	0.00437	0	0	0.0101	0.0387	0	0	1.05e-05	0	9.52e-06	0	0	0	0.0107	0	0	0	0	0	2.94019997800014e-11	3.79673523350612e-15	14.4205896874629		0.269	
C94280	Triethylene glycol bis(2-ethylhexanoate)	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.410159977893661	0.0947688296445507	1.02333448269746		0.011	
C94361065	Cyproconazole	0.0268	0	0	0.000337	0	0.0216	2.17e-06	0	0	0	0	0	0	0	0	0	0.00285	0.00111	0	0	0.0217	0	0	0.0163	0	0	2.95863046982369e-12	1.28313291447742e-12	11.8917283545103		0.0105	
C94462	Isopentyl benzoate	0.00166	0.00371	3.9e-05	0	0	0	0	0	0	0	0	0.00285	0	0	0.000329	0	0	0	0	0	0	0	0	0	0	0	1.84713796821408e-07	1.38311528952862e-08	7.85914161777987		0.00552	
C94473	2-Phenylethyl benzoate	0.00552	0	0	0	0	0	0.000247	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.156	0	0	1.17659069193731e-08	1.40715557510538e-10	9.85165788431747		0.0732	
C94597	Safrole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.29298495338429e-17	4.1205792383187e-19	18.3850417300048	EAS hi AUC low	0	
C94600	Dimethyl hexahydroterephthalate	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00243126073659127	0.000312516977088123	3.50512638518256		0	
C94713	2-Ethoxyphenol	0	0	0	0	0	9.35e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0325	0	0	0	0	1.50995161136106e-12	1.17156550329733e-13	12.931233424587		0	
C94746	MCPA	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.27010732854103e-13	8.94991001726752e-14	13.0481813310752		0	
C94757	2,4-Dichlorophenoxyacetic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.41648371743621e-09	1.44242234327157e-10	9.84090755896702		0	
C94804	2,4-D 1-butyl ester 	0	0	0	0	0	0.000395	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0944	0	0	0	0	4.07539050334281e-06	1.53586817130645e-06	5.81364605965033		0	
C94815	MCPB	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.80876903857946e-14	2.82126504342277e-13	12.5495561121825		0	
C94826	2,4-DB	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.15300485253784e-10	6.54416564627714e-10	9.18414571631203		0	
C94917	N,N'-Disalicylidene-1,2-diaminopropane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.25950923073285e-16	1.12333852879314e-18	17.9494893452243	EAS hi AUC low	NA	
C94962	2-Ethyl-1,3-hexanediol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000272984178616574	9.05837473428499e-06	5.04294971703065		0.0021	
C950378	Methidathion	0	0	0	0	0	9.41e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0771	0	0	0	0	0.999999999999907	0.999999999998804	5.19338557112583e-13		NA	
C95136	Indene	0.0117	0	0	0	0	0.0837	2.68e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0039	0.00432	0	0.0132	0	0	9.63019753552094e-15	6.97454699781584e-18	17.1564839948985	EAS hi AUC med	0	
C95147	1,2,3-Benzotriazole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.835649512593458	0.194946340127298	0.710084913732927		0	
C95169	Benzothiazole	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.992736633788568	0.458599061043551	0.338566838799325		0	
C95266403	Trinexapac-ethyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.24147837669033e-05	8.44460984441776e-06	5.07342041078577		NA	
C95385	1H-Imidazole-1-ethanol, 2-(8-heptadecenyl)-4,5-dihydro-	0.0142	0.0143	0	0.00742	0.00877	0	0	0	1.73e-06	0	0	0	0	0	0	0.0101	0	0.0145	0	0.00403	0	0	0.0032	0	0.00267	0	0.992352882914694	0.967753328646166	0.0142353262242738		NA	
C95487	o-Cresol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.68522763223749e-17	7.56628455479697e-23	22.1211173296763	EAS hi AUC low	0.0303	
C95498	2-Chlorotoluene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.36200665825051e-07	2.90786338786545e-10	9.53642600059493		0	
C95501	1,2-Dichlorobenzene	0.00153	0.00507	0	0.00817	0	0	0	0	0	0	0	0	0	0	0	0.00307	0	0.0214	0	0.0332	0	0	0	0	0	0	9.6986759356479e-05	3.34298022823142e-07	6.47586619199714		0	
C95534	2-Methylaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0275882158052011	0.00153064412870523	2.81512577004948		0	
C95545	1,2-Phenylenediamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.429886564010731	0.120605008510499	0.918634656347559		0.0201	
C95578	2-Chlorophenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.15969166581313e-14	5.85782489924529e-19	18.2322636142912	EAS hi AUC low	0.0293	
C95636	1,2,4-Trimethylbenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.64473260865056e-14	1.20201172964126e-17	16.9200912943186	EAS hi AUC low	0	
C95658	3,4-Dimethylphenol	0	0	0	0	0	0.00207	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0352	0	0	0	0	0	3.95120753166142e-19	1.64024051808858e-25	24.7850924641353	EAS hi AUC low	0.0874	
C95737681	Pyriproxyfen	0.0259	0	0	0	0	0	7.46e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00414	0.00269	0	0.0388	0	0	0.00226637595769966	0.00106524091888309	2.97255215944694		NA	
C95749	3-Chloro-4-methylaniline	0.00428	0.012	0	0	0.000445	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0948	0	0	0	0	0	0	0	0.0450723901183933	0.00892487298206183	2.04939795600929		0	
C957517	Diphenamid	0	0	0	0	0	7.8e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0927	0	0	0	0	0	8.29513098212982e-06	0.000671448042775466	3.17298758777401		NA	
C95761	3,4-Dichloroaniline	0	0	0	0	0	9.65e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0393	0	0	0	0	0	0.486705288467325	0.134763364919883	0.870428153613354		0.00428	
C95807	2,4-Diaminotoluene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0287026593663074	0.00223150702198389	2.65140174220725		0.139	KNN hi AUC low
C95830	4-Chloro-1,2-diaminobenzene	0	0	0	0	0	0	0	0	0.00104	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0675	0	0.535109139257624	0.187719767609007	0.726489992101714		0	
C95874	2,5-Dimethylphenol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.07472750837779e-18	6.06318945274762e-24	23.2172988614207	EAS hi AUC low	0.00465	
C95932	1,2,4,5-Tetramethylbenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.18793215458575e-14	1.58754527862911e-17	16.799273879278	EAS hi AUC low	0	
C95943	1,2,4,5-Tetrachlorobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	5.26982235843187e-05	2.40587946056661e-07	6.61872613548419		0.00153	
C95954	2,4,5-Trichlorophenol	0.00613	0	0	0	0	0.0937	0	0	0	0	0	0	0	0	0	0	0.00181	0	0	0	0.0284	0	0	0	0	0	1.35843940993273e-14	9.46504534344724e-19	18.0238773011548	EAS hi AUC med	0.00424	
C959988	Endosulfan I	0.0619	0	0	0	0	0.00955	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0216	0	0.00575	0	0	4.10950001504954e-09	1.29325218486771e-10	9.88831677920522		0.0295	
C960714	Triphenylborane	0.101	0	8.77e-06	0	0	0.028	1.13e-07	0	0	0	0.017	0	0	0	1.02e-05	0	0	0	0	0	0.00146	0.00162	0	0.00336	0	0	3.28291311655536e-06	8.23013491915403e-10	9.08459304520525		0.0652	
C96093	Styrene oxide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.77778299971412e-15	1.71631744944439e-16	15.7654023821101	EAS hi AUC low	NA	
C96182535	Tebupirimfos	0	0	0	0	0	0.000385	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0673	0	0	0	0	0	0.998572415836768	0.997109234655656	0.00125726153836371		NA	
C96184	1,2,3-Trichloropropane	0	0	0	0	0	0	0.000631	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.076	0	0	0.999373983417762	0.997740691470996	0.000982315322078918		0	
C96231	1,3-Dichloro-2-propanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.59804817933319	0.0122832723823619	1.91068591753704		0	
C96242	3-Chloro-1,2-propanediol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.9171073727356	0.0408997696793464	1.3882791376472		0	
C962583	Diazoxon	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.933290579675135	0.63510404948772	0.197155118146511		0.0237	
C96297	2-Butanone oxime	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999611217198586	0.999179001791508	0.000356701437264966		0	
C96413	Cyclopentanol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00139665752111732	2.89825975934519e-05	4.53786269305579		0	
C96457	Ethylene thiourea	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999997	0.999999999999999	2.89298239965986e-16		NA	
C96480	4-Butyrolactone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.994553004502905	0.881970748905436	0.0545458182691074		NA	
C96489713	Pyridaben	0.1	0	0	0	0	0.00196	0	0.0889	0.00385	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0272	0.0118685296225001	0.0200936180912476	1.69694185640315	EAS low AUC hi	NA	
C96708	2-tert-Butyl-4-ethylphenol	0.0193	0	0	0	0	0	2.1e-06	0	0	0	0	0	0	0	0	0	0.00416	0	0	0	0	0	0	0.0506	0	0	1.00776107727734e-18	2.11343030482401e-27	26.6750120694481	EAS hi AUC med	0	
C96764	2,4-Di-tert-butylphenol	0	0	0	0	0	0	0	0	2.39e-05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0574	8.03228216671535e-19	7.21676778401482e-28	27.1416572688942	EAS hi AUC low	0.0274	
C96833	Iopanoic acid	0.0454	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00789	0.000934	0	0	0	0	1.78639072459639e-09	8.00420324518664e-07	6.09668189215697		NA	
C97007	1-Chloro-2,4-dinitrobenzene	0	0.0638	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0482	0	0	0	0	0	0	0	0.886477329032752	0.413680908118562	0.38333452186515		0.00362	
C97234	Dichlorophen	0.0058	0.0643	0	0.00502	0	3.4e-06	0	0	0.00443	0	0	0	0	0	0.000504	0	0.000876	0	0	0	0	0.0463	0	0	0.00565	0	1.48625677290893e-18	3.23630741076097e-23	22.4899502322834	EAS hi AUC med	0.138	KNN hi AUC med
C97322877	Troglitazone	6.25e-05	0.000321	0	0	0	0.0854	0	0	0.0529	0	0	0	0	0	0	0	0	0	0	0	0	0.104	0	0	0	0	2.22911641322135e-12	2.01176099556035e-12	11.6964236162974		NA	
C97529	2-Methoxy-4-nitroaniline	0	0	0	0	0	0	0	0	0.00046	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.151	0	0.000161954761718667	4.68618885538163e-05	4.32918021313611		0	
C97530	Eugenol	0	0	0	0	0	0.0596	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0413	0	0	0	0	0	9.30368368967169e-18	1.0152971631634e-21	20.9934068272742	EAS hi AUC low	0.0124	
C97541	Isoeugenol	0.0124	0.00199	0	0.0471	0	0	0	0	0	0	0	0	0.0026	0	0.0137	0.00885	0	0.00071	0	0.00113	0	0	0	0.000879	0	0	9.09529089734317e-18	3.85759639218206e-21	20.4136832131404	EAS hi AUC med	0	
C97563	2-Amino-5-azotoluene	0.142	0	0	0	0	0	8.21e-06	0	0	0	0	0	0	0	0	0	0.000843	0	0	0	0.0252	0	0	0.0163	0	0	0.0736786412401781	0.00835825950286071	2.0778841492356	EAS low AUC hi	0	KNN low AUC hi
C97596	Allantoin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1	0.999999999909405	3.93447052862763e-11		0.0207	
C97778	Disulfiram	0	0	0	0	0.0329	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0043	0	0	0	0	0	0	1	1	0		NA	
C97789	N-Dodecanoyl-N-methylglycine	0	0	0	0	0	0.00026	0	0	0.00105	0	0	0	0	0	0	0	0	0	0	0	0	0.111	0	0	0.0386	0	0.990399602745292	0.962981196968136	0.0163821927640488		0	
C97886458	Dithiopyr	0.0183	0	0	0.00238	0	0.0177	0	0	0	0	0	0	0	0	0.00505	0	0.00614	0	0	0	0.00102	0.0126	0	0	0	0	0.282257083468834	0.109513610281063	0.96053190363073		0.00886	
C97994	Tetrahydrofurfuryl alcohol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.712907991131181	0.0976267574271866	1.01043113509611		NA	
C98000	Furfuryl alcohol	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3.42185821049099e-10	1.19632301124285e-11	10.9221515435413		NA	
C98011	Furfural	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4.90585854701859e-10	5.46608094944294e-12	11.26232394095		NA	
C98066	tert-Butylbenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.23135497828728e-13	2.93907011228643e-19	18.5317900535953	EAS hi AUC low	0	
C98077	Benzotrichloride	0	0	0	0	0	0.0916	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0155	0	0	0	0	0	2.3850082041912e-08	1.01981784340849e-11	10.9914773935981		0	
C98319267	Finasteride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000739764687723436	0.00217670511606662	2.66220040198299		NA	
C98511	4-tert-Butyltoluene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.19859518202051e-14	2.60060561826325e-20	19.5849255035513	EAS hi AUC low	0.0234	
C98522	4-tert-Butylcyclohexanol	0	0	0	0	0	0.0501	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00468	0	0	0	0	2.42199063831396e-10	7.37081353658914e-15	14.132484575241		0.248	KNN hi AUC low
C98533	4-tert-Butylcyclohexanone	0	0	0.000515	0	0	0	0	0	0	0.0955	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.07128968661071e-08	3.40291404876469e-10	9.46814902023085		0.0491	
C98544	4-tert-Butylphenol	0.161	0	0	0	0	0.0522	0	0	0	0	0	0	0	0	0	0	0.000279	3.75e-05	0	0	0.015	0	0	0	0	0	4.28202741695351e-17	1.15767494358379e-27	26.9364133663643		0.45	
C98566	1-Chloro-4-(trifluoromethyl)benzene	0	0	0	0	0	0	0.000219	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0709	0	0	1.22548846663453e-07	1.11053831208126e-10	9.95446645428032		0	
C98730042	Benoxacor	0.000355	0.00117	0.363	0	0	0	0	0	0	4.9e-06	0.075	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.517733655103595	0.232136607541665	0.634256366654397		NA	
C98862	Acetophenone	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.47813043579058e-17	2.5752170002124e-17	16.5891861693319	EAS hi AUC low	0.0491	
C98873	Benzal chloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.25230267106766e-08	4.5205652053213e-11	10.3448072620456		0	
C98886443	Fosthiazate	0	0	0	0	0	0.000267	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.114	0	0	0	0	0.999999999999979	0.999999999999585	1.80425668992157e-13		NA	
C98920	Niacinamide	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.963384541068656	0.481584669996635	0.317327346172644		0	
C989388	Rhodamine 6G	0	0.158	0.000365	0	0	0	0	0	0	0.00229	0.00115	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00955	0.00116	5.07630059173018e-06	2.86441572709285e-05	4.54296395044245		0	
C98953	Nitrobenzene	0	0	0	0	0	0.138	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0239	3.34e-07	0	0	0	0	0.8566454718692	0.303851783136866	0.517338210676779		0.0224	
C98967409	Flumetsulam	0	1.44e-07	0.00374	0	0	0	0	0	0	0	0	0.25	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999991009833638	0.931059119625905	0.0310227416694307		0	
C99070	3-Dimethylaminophenol	0.00715	0	0	0	7.72e-07	0.0631	0	0	0	0	0	0	0	0	0	0	0	0	0.00924	0	0.00353	0.0061	0	0	0	0	5.0184565510581e-07	2.61791613883215e-07	6.58204426955981		NA	
C99081	3-Nitrotoluene	0	0	0	0	0	0	0.000398	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0774	0	0	0.173289069481202	0.0148128509318569	1.82936134763562		0	
C99309	Dicloran	0	0	0	0	0	0.0773	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0046	0.00773	0	0	0	0	0.848518127930552	0.368123794996202	0.43400610947115		0.00362	
C99514	1,2-Dimethyl-4-nitrobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.027554672536893	0.0028192069134275	2.54987304826388		0.0121	
C99547	3,4-Dichloronitrobenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.885937697083863	0.377260830534758	0.423358283496802		0.00362	
C99558	2-Methyl-5-nitroaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.170906680017354	0.0254950694042751	1.59354380143125		0.0121	
C99592	2-Methoxy-5-nitroaniline	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000177225258940719	4.20484424629006e-05	4.37625008648427		0	
C99607702	Cloquintocet-mexyl	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000561022190031627	0.00230083976072998	2.63811362620489		0.00936	
C99627	1,3-Diisopropylbenzene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.7587722723607e-12	1.39882650287495e-16	15.8542361479218	EAS hi AUC low	0	
C99638	1,3-Benzenedicarbonyl dichloride	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	9.1267290933202e-15	3.7167175571738e-14	13.4298404407933		NA	
C99650	1,3-Dinitrobenzene	0	0	0	0	0	0	0	0	3.29e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0591	0.907195698855785	0.400472085442407	0.397427750643		0	
C99661	Valproic acid	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00518025479684409	0.000914535853231586	3.03879926388312		0.011	
C99718	4-(Butan-2-yl)phenol	0.163	0	0	0.000134	0	0.0129	0	0.000402	0	0	0	0	0	0	0.000147	0	3.56e-05	0.000124	0.000161	0	0.00879	0.00181	0	0	0	0	3.83353127055381e-17	3.24435155396312e-26	25.4888720922926		0.993	
C99763	Methylparaben	0.00684	1.88e-07	0	0.00454	0	0.0303	0	0	0	0	0	0	0	0	0.0224	0.000696	0.000398	0	0	0	0.00219	0	0	0	0	0	4.20936408795472e-14	4.84474936084668e-19	18.3147286859026	EAS hi AUC med	0.275	KNN hi AUC med
C99854	gamma-Terpinene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.000145714509144181	1.95257444960856e-06	5.70939239794349		0.0161	
C99865	alpha-Terpinene	0.0161	0.0482	0	0.00854	0.0164	0	0	0	0	0	0	0	0	0.00162	0	0.000411	0	0.0177	0.0117	0	0	0	0	0	0	0	4.11261735275082e-08	4.37090758261944e-10	9.35942837602756		0	
C99876	p-Cymene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.09854352197835e-13	1.23233924342776e-17	16.9092697213373	EAS hi AUC low	0	
C99898	4-Isopropylphenol	0.021	0	0	0.0294	0	0.0252	0	0	0	0	0	0	0	0	0.00391	0	0.00125	0.00175	0	0	0.0247	0	0	0	0	0	2.7915727697549e-17	2.23172032516589e-26	25.6513602312611	EAS hi AUC med	0.45	KNN hi AUC med
C99934	4-Hydroxyacetophenone	0	0	0	0	0	1.39e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0435	0	0	0	0	8.55816391131201e-20	1.54350261209706e-25	24.811492631217	EAS hi AUC low	0.0164	
C99967	4-Hydroxybenzoic acid	0	0	0	0	0	0.05	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00225	9.49e-05	0	0	0	0	6.1688217522381e-17	1.46675079422857e-22	21.8336436679461	EAS hi AUC low	0.275	KNN hi AUC low
C99978	N,N,4-Trimethylaniline	0.00737	0	0	0	0	0.0488	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0267	0.0129	0	0.0389	0	0	0.361087667103632	0.12819028577913	0.89214488427404		0.0518	
C99990	4-Nitrotoluene	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0418373331307906	0.00220211887413812	2.65715924077355		0.0121	
C999973	Hexamethyldisilazane	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999999999984	0.99999999856873	6.21592466964284e-10		NA	
CNOCAS34742	Milbemectin (mixture of 70% Milbemcin A4, 30% Milbemycin A3)	0	0.000235	0	0	0	0	0	0	0.0868	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0718	0	2.98038081147026e-06	5.33740192278767e-07	6.27267009225422		0	
CNOCAS47248	CI-1018	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.104	0	0	0	0	0.978961243740843	0.299437409801902	0.523693942618208		0	
CNOCAS47255	CP-465394	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	2.41298353733926e-05	0.000956315296107458	3.0193988976987		0	
CNOCAS47265	CP-471358	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	7.58378936952906e-05	0.000390709895729187	3.40814558901541		0	
CNOCAS47267	CP-642931	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.999999942004977	0.999611894859438	0.000168584637342854		NA	
CNOCAS47291	CI-1044	0	0	0	0	0	6.37e-06	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0487	0	0	0	0	0.982079139690179	0.278611066869808	0.555001636709501		0	
CNOCAS47292	PD 0200347	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.357219807715332	0.314029577742587	0.503029444775729		NA	
CNOCAS47299	CP-422935	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	6.10966336571689e-09	1.20514701933024e-07	6.91895996903177		NA	
CNOCAS47305	CP-608039	0	0	0	0	0	0	0	0	0	0	0	0	0	0.155	0	0	0	0	0	0	0	0	0	0	0	0	0.540599707778316	0.0693621056898616	1.15887773105079		NA	
CNOCAS47311	GSK163929B	0	6.09e-07	0	0	0	0	0	0	0.0847	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00419	0.000477	0.996861861662537	0.415840933662011	0.381072762747343		NA	
CNOCAS47325	SB413217A	8.97e-05	0	0	0	0	0	0.075	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0019	0.00172	0	0	0.860861837009253	0.371900320427966	0.429573447454318		NA	
CNOCAS47328	MK-274	0	0	0	0	0	6.81e-05	0	0	0.085	0	0	0	0	0	0	0	0	0	0	0	0	0.0186	0	0	0.019	0	2.17600748567988e-06	0.000128612260524059	3.89071762842473		NA	
CNOCAS47330	PharmaGSID_47330	0	0	0	0	0	6.33e-06	0	0	0.00133	0	0	0	0	0	0	0	0	0	0	0	0.0167	0	0	0	0.0889	0	0.0155927906717728	0.0040654119085841	2.39089544501155		NA	
CNOCAS47333	PharmaGSID_47333	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0478935380493884	0.0604178106489006	1.2188350162413		NA	
CNOCAS47334	MK-968	0	0.0119	0	0	0	0	0	0	0.0128	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0922	0.240822491240774	0.0857768925576114	1.06662969101286		NA	
CNOCAS47342	SR125047	0	0	0	0	0	0	0	0	0.0016	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0384	1.64664639211361e-13	1.02718028181827e-10	9.98835332609348		NA	
CNOCAS47346	SSR162369	6.23e-05	0	0	0	0	0	0	0.21	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.99999999999815	0.999995308347124	2.03756373491321e-06		NA	
CNOCAS47351	SSR240612	0.00262	0.00904	0	0	0	0.0239	0	0	0	0	0	0	0	0	0	0	0	0	0.00244	0	0.00436	0.0205	0	0	0	0.00514	0.000149261185073588	8.10593417637166e-05	4.09119692723566		NA	
CNOCAS47353	SSR241586	0	0.0255	0	0	3.19e-07	0	0	0	0.0297	0	0	0	0	0	0	0	0	0	0.0202	0	0	0	0	0	0.0015	0	0.044083479880389	0.0112352447539528	1.9494174622628		NA	
CNOCAS47362	SSR150106	0	0	0	0	0	0.000238	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0214	0	0	0	0.0257	7.29693017574616e-09	1.94464581315532e-07	6.71115948708863		NA	
CNOCAS47364	SSR103800	0	0.0171	0.00172	0	0	0	0	0	0	0	0	0.141	0	0	0	0	0	0	0	0	0	0	0	0	0.0205	0	0.0397212788077691	0.00916931418453447	2.03766314601053		0	
CNOCAS47366	SAR115740	0	0	0	0	0	0	0.00019	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.065	0	0	0	0.965077787643154	0.330255772893229	0.481149582150191		NA	
CNOCAS47374	SSR161421	5.98e-06	3.94e-05	0	0	0	0.000218	0	0	0.0838	0	0	0	0	0	0	0	0	0	0	0	0	0.0191	0	0	0	0.0297	0.000225849984870306	0.000557440048944445	3.25380183287645		NA	
CNOCAS47377	AVE6324	0.0137	0	0	0	0	0.0528	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00396	0.0171	0.00201	0	0	0.00552	0.798225904479077	0.21716761784409	0.663204932490546		0	
CNOCAS47379	SSR126768	0	0.000602	0	0	0	0	0	0	0.131	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.0121	4.38376911520283e-05	0.000136993605315883	3.86329970467456		NA	
CNOCAS47383	AVE3247	0	0	0	0	0	0.000391	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.168	0	0	0	0	0.901259606352838	0.180037216070883	0.744637711210126		0.0137	
CNOCAS47385	SAR377142	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.964472887583821	0.455250182514472	0.341749871419891		NA	
CNOCAS47387	SAR102779	5.9e-05	0.0137	0	0	0	1.48e-05	0	0	0.0189	0	0	0	0	0	0	0	0	0	0	0	0	0.0447	0	0	0.00406	0	0.174758242675902	0.05753015776955	1.2401044349724		NA	
CNOCAS47389	SAR150640	0	0.00566	0	0	9.46e-07	0	0	0	0	0	0	0	0	0	0	0	0	0	0.00461	0	0	0	0	0	0.00526	0	4.890932746903e-07	2.83435499425108e-06	5.54754575663296		NA	
CNOCAS47708	Igepal CO-890	0	2.1e-05	0	0.0693	0	0	0	0	0	0	0	0	0	0	0	0	2.89e-05	0.0191	0	0	0	0	0	0	0	0	-1	-1	0		NA	
CNOCAS47796	Formalin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	-1	-1	0		NA	
