Piir, G.; Sild, S.; Roncaglioni, A.; Benfenati, E.; Maran, U. QSAR model for the prediction of bio-concentration factor using aqueous solubility and descriptors considering various electronic effects. SAR QSAR Environ. Res. 2010, 21, 7-8, 711-729.

627 compounds

ID	Name	Details
t2	n-nonane	View
t3	2,4,6-trimethyl-3-heptene	View
t4	1-decene	View
t8	1-dodecene	View
t9	n-dodecane	View
t10	isodecanol	View
t11	isotridecanol	View
t15	3,5,5-trimethyl cyclohexene	View
t16	1,3,5-trimethyl cyclohexane	View
t17	cis-1,1,3,5-tetramethyl cyclohexane	View
t18	iso-butyl cyclohexane	View
t19	naphthalene	View
t20	2-methylnaphthalene	View
t22	1,3-dimethylnaphthalene	View
t24	1,3,5-trimethylbenzene	View
t27	1-hydroxy-2-tert butyl-4-methyl benzene	View
t28	acenaphthylene	View
t29	fluorene	View
t30	anthracene	View
t31	phenanthrene	View
t32	pyrene	View
t33	1-phenyl naphthalene	View
t35	9-methyl anthracene	View
t36	1-methylphenanthrene	View
t37	fluoranthene	View
t38	1-methylpyrene	View
t39	triphenylene	View
t41	chrysene	View
t42	benzo[a]pyrene	View
t44	dibenzo[a,h]anthracene	View
t46	3,6-dichlorodibenzofuran	View
t52	1,2,4-trichlorodibenzo-p-dioxin	View
t53	1,2,3,4-tetrachlorodibenzo-p-dioxin	View
t54	1,2,3,7-tetrachlorodibenzo-p-dioxin	View
t56	perfluorooctanic acid	View
t57	perfluorooctane sulfonic acid	View
t58	isoprene	View
t60	1-nonene	View
t62	2,2,4-trimethyl-1,3-pentanediol	View
t63	2,2-dimethyl-1,3-propanediol	View
t64	pentaerythritol	View
t65	diethyl ether	View
t66	n-butyl ether	View
t69	1-(2-hydroxypropoxy)propan-2-ol	View
t72	tert-butyl alcohol	View
t74	1,2,4-trimethylbenzene	View
t78	m-diethylbenzene	View
t79	m- divinylbenzene	View
t81	p-sec-butylphenol	View
t82	p-octylphenol	View
t84	2,4-di-tert-butylphenol	View
t89	p-sec-butylphenyl-2,3-dihydroxypropylether	View
t90	o-chlorophenol	View
t91	p-chlorophenol	View
t92	m-chlorophenol	View
t93	o-bromophenol	View
t94	p-bromophenol	View
t95	m-bromophenol	View
t96	4-chloro-m-cresol	View
t98	4-chloro-o-cresol	View
t100	3,4-dichlorophenol	View
t102	2,3-dichlorophenol	View
t103	2,5-dichlorophenol	View
t104	3,5-dichlorophenol	View
t106	2,3,4,6-tetrachlorophenol	View
t107	p-t-butyl benzoic acid	View
t108	o-chloro benzoic acid	View
t111	methylcyclohexane	View
t113	1,5,9-cyclododecatriene	View
t114	cyclododecane	View
t116	2,3,6-trichlorobenzoic acid	View
t117	4-cyclohexene-1,2-dicarboxylic acid	View
t118	2,6-dicyclohexylphenol	View
t121	2,2'-methylenebis(3,4,6-trichlorophenol)	View
t122	2,2-bis(4'-hydroxyphenyl) propane	View
t123	2-hydroxy-4-n-octoxybenzophenone	View
t124	2,2-diphenyl-2-hydroxyacetic acid	View
t125	methyl-5-norbornene-2,3-dicarboxylic acid	View
t126	2,4-dichloro-1-hydroxynaphthalene	View
t127	3-hydroxy 2-naphthoic acid	View
t128	2,6-naphthalenedicarboxylic acid	View
t129	4,5-dichloronaphtalene-1,8-dicarboxylic acid	View
t130	1-naphthol-4-sulfonic acid	View
t131	7-hydroxy -1,3-naphthalene disulfonic acid	View
t132	2-naphthol-3,6-disulfonic acid	View
t133	tetrahydronaphthalene	View
t134	1?isopropyl?decahydronaphthalene	View
t135	5-ethylidene-2-norbornene	View
t136	camphene	View
t137	dicyclopentadiene	View
t138	acenaphthene	View
t139	2-ethylanthraquinone	View
t140	2-pentylanthraquinone	View
t144	3,5-di-tert-butylbiphenyl-4-ol	View
t146	1-naphthaleneacetic acid	View
t147	2,4,6-trimethylphenol	View
t148	diphenylene oxide	View
t149	3-ethyl-nonane	View
t150	2,2,3-trimethyl decane	View
t151	1,1,6-trimethyl tetralin	View
t154	n-hexyl cyclohexane	View
t155	5-ethyl-1-nonene	View
t156	1,3,5-tribromobenzene	View
t160	tetrabromo-2-chlorotoluene	View
t161	pentabromotoluene	View
t162	2,2'-dichlorobiphenyl	View
t163	2,3-dichlorobiphenyl	View
t164	2,5-dichlorobiphenyl	View
t166	3,5-dichlorobiphenyl	View
t167	2,4,4'-trichlorobiphenyl	View
t168	2,4',5-trichlorobiphenyl	View
t169	2,4,5-trichlorobiphenyl	View
t171	2,2',3,3'-tetrachlorobiphenyl	View
t172	2,3',4,4'-tetrachlorobiphenyl	View
t173	2,2',3,4'-tetrachlorobiphenyl	View
t175	2,2',5,6'-tetrachlorobiphenyl	View
t176	2,3',5,5'-tetrachlorobiphenyl	View
t177	2,3,5,6-tetrachlorobiphenyl	View
t178	2,3,4,5-tetrachlorobiphenyl	View
t179	3,3',4,4'-tetrachlorobiphenyl	View
t180	2,3,4,5,6-pentachlorobiphenyl	View
t181	2,3,3',4,4'-pentachlorobiphenyl	View
t182	2,2',4,5,5'-pentachlorobiphenyl	View
t184	2,2',4,5',6-pentachlorobiphenyl	View
t185	2,2',4,6,6'-pentachlorobiphenyl	View
t188	2,3',4,4',5-pentachlorobiphenyl	View
t191	o-chlorotoluene	View
t192	p-chlorotoluene	View
t193	o-dichlorobenzene	View
t194	1,3-dichlorobenzene	View
t195	p-dibromobenzene	View
t196	3-trifluoromethyl-chlorobenzene	View
t197	1,2,3-trichlorobenzene	View
t198	1,3,5-trichlorobenzene	View
t200	1,2,4,5-tetrachlorobenzene	View
t201	pentachlorobenzene	View
t202	1,2,3,4-tetrachlorobenzene	View
t203	4,4'-dibromobiphenyl	View
t207	2,2',4,4'-tetrachlorodiphenyl ether	View
t208	2,4,4',5-tetrachlorodiphenyl ether	View
t209	2,2',4,4',6-pentachlorodiphenyl ether	View
t210	2,3',4,4'-tetrachlorodiphenyl ether	View
t212	2,2',4,4',5-pentachlorodiphenyl ether	View
t213	3,3',4,4',6-pentachlorodiphenyl ether	View
t214	hexachlorobutadiene	View
t215	chlordane	View
t216	p,p'-dichlorodiphenyldichloroethylene	View
t218	dichloromethane	View
t219	trichloromethane	View
t221	tribromomethane	View
t222	1,1,1-trichloroethane	View
t225	hexachloroethane	View
t226	bromochloromethane	View
t227	1,2-dibromoethane	View
t229	1,10-dibromodecane	View
t230	1,1,2,2-tetrabromoethane	View
t231	1,3-dibromo-2,2-bis(bromomethyl) propane	View
t232	1,2-dichloropropane	View
t233	1,2,3-trichloropropane	View
t234	1,2,2,3-tetrachloropropane	View
t235	1,1,2-trichloro-1,2,2-trifluoroethane	View
t236	1,1,2,2-tetrachloro-1,2-difluoroethane	View
t239	tetrachloroethylene	View
t240	allylchloride	View
t244	4-isopropenyl-chlorobenzene	View
t245	benzotrifluoride	View
t248	1,2,3,4,5,6-hexachlorocyclohexane	View
t249	1,2,3,4,5-pentabromo-6-chlorocyclohexane	View
t251	4,4'-dichlorobenzilic acid ethyl ester	View
t252	1,1-bis(p-chlorophenyl)-2,2,2-trichloroethanol	View
t253	2-benzoyl benzoic acid methyl ester	View
t256	1-methoxynaphthalene	View
t257	2-(2-methylpropoxy)naphthalene	View
t259	(2-chloroethoxy-phenylmethyl)benzene	View
t262	chloro-triphenyl-methane	View
t263	heptachlor	View
t266	9-octadecenylsuccinic acid	View
t268	2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenol	View
t269	2,2-bis(4'-hydroxy-3',5'-dibromophenyl) propane	View
t271	benzene-1,2-dicarboxylic acid bis (2-ethylhexyl) ester	View
t272	diheptyl benzene-1,2-dicarboxylate	View
t273	bis(8-methylnonyl) benzene-1,2-dicarboxylate	View
t274	tris(2-ethylhexyl) benzene-1,2,4-tricarboxylate	View
t276	trioctylamine	View
t277	bis(2-aminoethyl)amine	View
t279	2- (2-aminoethylamino)ethanol	View
t281	tris(2-hydroxypropyl)amine	View
t282	2-butanone oxime	View
t284	bis(cyanoethyl)amine	View
t286	n-methylaniline	View
t287	n-methylacetanilide	View
t288	n,n-diethylaniline	View
t289	n,n-dimethylaniline	View
t290	n-ethylaniline	View
t291	4-methylphenylene-1,3-diamine	View
t293	2,5-dimethyl aniline	View
t294	diphenylamine	View
t295	n,n'-diphenyl-p-phenylenediamine	View
t296	m-phenylenediamine	View
t297	n-methyl-o-toluidine	View
t298	n-ethyl-p-toluidine	View
t299	n-methyl-m-toluidine	View
t300	o-chloroaniline	View
t301	3,4-dichloroaniline	View
t303	2,4-dichloroaniline	View
t304	4-chloro-2-methylaniline	View
t306	1,3-bis(aminomethyl)benzene	View
t307	n,n-dimethylbenzylamine	View
t308	2-nitroaniline	View
t312	n-nitrosodiphenylamine	View
t313	nitrobenzene	View
t314	o-nitrotoluene	View
t315	m-nitrotoluene	View
t316	p-nitrotoluene	View
t323	3-aminophenol	View
t324	4-ethoxyaniline	View
t327	p-nitrophenol	View
t328	o-nitroanisole	View
t330	m-nitroanisole	View
t331	2-nitro-p-cresol	View
t334	2,4,6-trichlorophenyl (4'-nitrophenyl)ether	View
t335	phthalonitrile	View
t336	terephthalonitrile	View
t339	3-(3,4-dichlorophenyl)-1,1-dimethyl urea	View
t340	n,n'-dicyclohexylmethanediimine	View
t342	2,2'-dichlorohydrazobenzene	View
t344	3,3'-dichloro-4,4'-diaminodiphenylmethane	View
t345	1-naphthalenamine	View
t346	1,5-diaminonaphthalene	View
t349	2-(n-phenylamino)naphthalene	View
t350	1-aminoanthraquinone	View
t351	2-aminoanthraquinone	View
t352	3,3'-dichlorobenzidine	View
t354	2-aminopyridine	View
t355	3-aminopyridine	View
t357	1,4-dioxane	View
t358	piperazine	View
t359	2,4,6-triamino-1,3,5-triazine	View
t360	furan	View
t361	o-aminobiphenyl	View
t363	2,2'-dichlorodiethyl ether	View
t364	trichloroacetic acid	View
t366	thiourea	View
t368	tris(2-chloroethyl)phosphate	View
t369	tris(1-chloropropan-2-yl) phosphate	View
t370	tris(2,3-dibromopropyl) phosphate	View
t372	tris(2-ethylhexyl) phosphate	View
t373	trimethyl phosphate	View
t374	tri-n-butyl phosphate	View
t378	2-hydroxy-4-methoxybenzophenone	View
t380	2-mercaptobenzothiazole	View
t381	2-mercaptobenzimidazole	View
t382	phenothiazine	View
t383	dibenzothiophene	View
t384	benzothiazole	View
t385	thiophene	View
t386	perfluorotributylamine	View
t387	triallylamine	View
t388	4-chloro-1-nitro-2(trifluoromethyl) benzene	View
t389	3-nitro-p-cresol	View
t390	5-nitro-o-cresol	View
t391	2-nitro-p-anisidine	View
t392	2,4-dichloro-6-nitrophenol	View
t393	n,n-diethyl-m-toluamide	View
t394	m-nitrobenzoic acid	View
t398	(2-methylphenyl)methanamine	View
t402	methyl benzimidazole-2-ylcarbamate	View
t403	5-nitrobenzimidazole	View
t404	2h-1,2,4-triazol-3-amine	View
t406	2-chloropyridine	View
t407	1-methylpiperidine	View
t408	hexa(methoxymethyl)melamine	View
t410	1,3,5-tris(2'-hydroxyethyl)isocyanuric acid	View
t411	3-hydroxy-n-phenylnaphthalene-2-carboxamide	View
t412	3,3'-dimethyl-4,4'-bis(acetoacetylamino)biphenyl	View
t413	3-[2-cyanoethyl-[4-(2,6-dichloro-4-nitrophenyl)diazenylphenyl]amino]propanenitrile	View
t416	2-carbamoyl-3,4,5,6-tetrachlorobenzoic acid	View
t422	o-ethylnitrobenzene	View
t423	bis(2,3,3,3-tetrachloropropyl) ether	View
t427	2-dimethoxyphosphinothioylsulfanyl-n-methylacetamide	View
t431	2,2-dichloropropionic acid	View
t432	1-chloro-4-[(prop-2-yn-1-yloxy)methoxy]benzene	View
t433	dicumylperoxide	View
t434	2-tert-butyl-4-(5-tert-butyl-4-hydroxy-2-methylphenyl)sulfanyl-5-methylphenol	View
t436	m-nitrobenzene sulfonic acid	View
t437	2-chloro-5-nitrobenzenesulfonic acid	View
t440	1,5,5-trimethyl-1-cyclohexen-3-one	View
t441	phenylphosphinic acid	View
t442	2-ethylhexyl diphenyl phosphate	View
t446	dimethoxy-(3-methyl-4-nitrophenoxy)-sulfanylidenephosphorane	View
t448	benzenesulfonamide	View
t449	dimethoxyphosphoryloxybenzene	View
t450	phosphoric acid [(e)-2-chloro-1-(2,4,5-trichlorophenyl)vinyl] dimethyl ester	View
t451	2-diethoxyphosphinothioyloxyimino-2-phenylacetonitrile	View
t452	benzophenone	View
t453	naphthionic acid	View
t455	7-amino-4-hydroxy-2-naphthalenesulfonic acid	View
t458	4-hydroxy-7-[(5-hydroxy-7-sulfonaphthalen-2-yl)carbamoylamino]naphthalene-2-sulfonic acid	View
t459	1-chloroanthraquinone	View
t460	2-chloroanthraquinone	View
t463	2-amino-8-naphthol-6-sulfonic acid	View
t464	tetrahydrothiophene-1,1-dioxide	View
t465	4,8-diamino-9,10-dihydro-1,5-dihydroxy-9,10-dioxoanthracene-2,6- disulphonic acid	View
t466	5-chloro-3-[2-(1,5-dioxonaphthalen-2-yl)hydrazinyl]-2-hydroxybenzenesulfonic acid	View
t468	2-(4-bromo-3-hydroxyquinolin-2-yl)indene-1,3-dione	View
t469	disperse red 206	View
t470	1-amino-2-(4-bromophenoxy)-4-hydroxyanthracene-9,10-dione	View
t471	2-chloro-5-((2-hydroxy-1-naphthyl)azo)toluene-4-sulphonic acid	View
t472	3-hydroxy-4-((4-methyl-2-sulphophenyl)azo)-2-naphthoic acid	View
t473	2-(thiocyanatemethylthio) benzothiazole	View
p1	2,3-dimethylheptane	View
p5	2,2,4,6,6-pentamethyl-3-heptene	View
p6	2,2,4,6,6-pentamethylheptane	View
p7	2,6-dimethyldecane	View
p12	pentachlorophenol	View
p13	bicyclo[4.3.0]nonane	View
p14	t-decalin	View
p21	2,3-dimethylnaphthalene	View
p23	2,3,6-trimethylnaphthalene	View
p25	1,2,3,4-tetramethyl benzene	View
p26	1,2,3,4-tetrahydro-1,4-dimethyl naphthalene	View
p34	2-methyl anthracene	View
p40	benz[a]anthracene	View
p43	perylene	View
p45	2,8-dichlorodibenzofuran	View
p47	2,3-dichlorodibenzo-p-dioxin	View
p48	2,3,7,8-tetrachlorodibenzofuran	View
p49	2,7-dichlorodibenzo-p-dioxin	View
p50	1,2,3,7-tetrachlorodibenzofuran	View
p51	1,2,3,8-tetrachlorodibenzofuran	View
p55	perflurohexane sulfonic acid	View
p59	2,4,4-trimethylpent-1-ene	View
p61	2,5-dimethylhexa-2,4-diene	View
p67	diisopentylether	View
p68	2-ethylhexylvinylether	View
p70	2,3-dibromo succinic acid	View
p71	di-(2-ethylhexyl) phosphoric acid	View
p73	alpha-methylstyrene	View
p75	1-ethenyl-2-ethylbenzene	View
p76	m-cymene	View
p77	p-diethylbenzene	View
p80	p-tert-butylphenol	View
p83	2,6-di-sec-butylphenol	View
p85	2,6-di-tert-butyl-p-cresol	View
p86	2,4,6-tri-tert-butylphenol	View
p87	2,6-di-t-butyl-4-ethylphenol	View
p88	4-(phenylmethyl)phenol	View
p97	6-chloro-m-cresol	View
p99	2,6-dichlorophenol	View
p101	2,4-dichlorophenol	View
p105	2,4,5-trichlorophenol	View
p109	4-tetradecyl-benzenesulfonic acid	View
p110	4-vinyl-1-cyclohexene	View
p112	cyclohexane	View
p115	menthol	View
p119	diphenyl methane	View
p120	2,2'-dihydroxy-5,5'-dichlorodiphenylmethane	View
p141	1-hydroxyanthraquinone	View
p142	7,12?dihydrotetraphene?7,12?dione	View
p143	benzanthrone	View
p145	1,4-dimethyl-2-(phenylmethyl)benzene	View
p152	1,4-diisopropyl cyclohexane	View
p153	1-isobutyl 2,5 dimethyl cyclohexane	View
p157	1,2,4-tribromobenzene	View
p158	1,2,3,4-tetrabromobenzene	View
p159	hexachlorobenzene	View
p165	3,3'-dichlorobiphenyl	View
p170	2,2',5,5'-tetrachlorobiphenyl	View
p174	2,2',4,5'-tetrachlorobiphenyl	View
p183	2,3,4,2',5'-pentachlorobiphenyl	View
p186	2,3',4,4',6-pentachlorobiphenyl	View
p187	3,3',4,4',5-pentachlorobiphenyl	View
p189	monochlorobenzene	View
p190	bromobenzene	View
p199	1,2,4-trichlorobenzene	View
p204	1,2,3,4-tetrachloronaphthalene	View
p205	tris(4-chlorophenyl)methanol	View
p206	2,4,4'-trichlorodiphenyl ether	View
p211	3,3',4,4'-tetrachlorodiphenyl ether	View
p217	4,4'-dichlorodiphenyltrichloroethane	View
p220	carbontetrachloride	View
p223	1,1,2-trichloroethane	View
p224	1,1,2,2-tetrachloroethane	View
p228	1-chlorobutane	View
p237	1,1-dichloroethylene	View
p238	trichloroethylene	View
p241	1,1,1,3,3,3-hexafluoro-2-propanol	View
p242	1,1,1-trichloro-2-methyl-2-propanol	View
p243	dibromoneopentylglycol	View
p246	diphenyl ether	View
p247	dibenzylether	View
p250	chlorocyclohexane	View
p254	endrin	View
p255	aldrin	View
p258	1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hept-2-ene-5,6-dicarboxylic acid	View
p260	1-(2-chlorophenyl)ethane-1,2-diol	View
p261	2,4,4'-trichloro-2'-hydroxydiphenyl ether	View
p264	n-pentadecane	View
p265	2,2,4,4,6,8,8-heptamethylnonane	View
p267	1,3,5-tri-tert-butylbenzene	View
p270	decabromodiphenyl	View
p275	triethylamine	View
p278	2-nitropropane	View
p280	triethanolamine	View
p283	dimethylformamide	View
p285	1-cyanoguanidine	View
p292	3,4-dimethylaniline	View
p302	2,5-dichloroaniline	View
p305	2,4,6-trichloroaniline	View
p309	3-nitroaniline	View
p310	4-nitroaniline	View
p311	4-chloro-2-nitroaniline	View
p317	o-chloronitrobenzene	View
p318	p-chloronitrobenzene	View
p319	3,4-dinitrotoluene	View
p320	1,2-dichloro-4-nitrobenzene	View
p321	n,n'-diphenylguanidine	View
p322	1-amino-2-methoxy-5-methyl-benzene	View
p325	n-acetyl-4-ethoxyaniline	View
p326	o-nitrophenol	View
p329	4-nitrophenyl methylether	View
p332	4-nitro-m-cresol	View
p333	2,4-dinitrophenol	View
p337	1,3-dicyanobenzene	View
p338	n-(3,4-dichlorophenyl)-n'-methoxy-n'-methyl urea	View
p343	4,4'-diaminodiphenylmethane	View
p347	1,8-diaminonaphthalene	View
p348	1-(n-phenylamino)naphthalene	View
p353	4-aminopyridine	View
p356	quinoline	View
p362	3,3'-dimethylbenzidine	View
p365	dimethyl sulfoxide	View
p367	tris(1,3-dichloropropan-2-yl) phosphate	View
p371	triethyl phosphate	View
p375	tris(2-butoxyethyl) phosphate	View
p377	p-phenylphenol	View
p379	3-methylthiophene	View
p395	3-nitrophthalic acid	View
p396	3,5-xylyl n-methylcarbamate	View
p397	o-cumenyl methylcarbamate	View
p399	p-(methylamino) benzoic acid	View
p400	n-cyclohexyl-n-nitroso hydroxylamine	View
p401	carbazole	View
p405	4-vinylpyridine	View
p409	isocyanuric acid	View
p414	2-[2-cyanoethyl-[4-(4-nitrophenyl)diazenylphenyl]amino]ethyl benzoate	View
p415	2-[2-acetyloxyethyl-[4-(2-chloro-4-nitrophenyl)diazenyl-3-(propanoylamino)phenyl]amino]ethyl acetate	View
p417	2-(2'-hydroxy-3',5'-di-t-butylphenyl)-5-chlorobenzotriazole	View
p419	2-isopropyl-4-methyl-6-hydroxypyrimidine	View
p421	pyridine-2,5-dicarboxylic acid	View
p424	bis(1-methyl-2-chloroethyl)ether	View
p425	p-acetaldehyde	View
p426	triallylphosphate	View
p435	o-toluenesulfonamide	View
p438	5-chloro-2-[4-chloro-2-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]benzenesulfonic acid	View
p439	1,1-bis(tert-butyldioxy)-3,3,5-trimethyl cyclohexane	View
p443	isodecyl diphenyl phosphate	View
p444	diphenyl tridecyl phosphite	View
p445	tris(2-propan-2-ylphenyl) phosphate	View
p447	ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidenephosphorane	View
p454	2-aminonaphthalene-1-sulfonic acid	View
p456	1-amino-8-naphthol-3,6-disulfonic acid	View
p457	4-amino-5-hydroxynaphthalene-1,3-disulfonic acid	View
p461	3,3'-dichloro-5,5'-benzidine disulfonic acid	View
p462	5-amino-2-[2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid	View
p467	3-nitro-n-phenyl-4-(phenylamino)benzenesulfonamide	View
e2	2,6-dichlorobenzoic acid	View
e6	3,4-dichlorobenzoic acid	View
e8	fenthion	View
e11	parathion	View
e21	aniline	View
e23	dichlorvos	View
e24	cycloheximide	View
e40	dichlorodifluoromethane	View
e41	2,2-dimethylpropanoic acid	View
e50	hexachlorocyclopentadiene	View
e68	2,4,6-trinitro-5-tertbutyl-1,3-xylene	View
e76	rotenone	View
e78	2,5-dichloro-4-(3-methyl-5-oxo-4h-pyrazol-1-yl)benzenesulfonic acid	View
e79	dibutyl phthalate	View
e83	butyl benzyl phthalate	View
e84	scarlet red	View
e89	2,4,6-trichloroanisole	View
e96	2,4,6-trichlorophenol	View
e98	2-amino-5-methyl-benzenesulfonic acid	View
e103	dinoseb	View
e104	picric acid	View
e112	4,4'-bis(dimethylamino)benzophenone	View
e118	2-chloronaphthalene	View
e128	orthocresol	View
e144	1,2-dibromo-3-chloropropane	View
e147	imidazolidine-2-thione	View
e160	alpha-methylbenzylamine	View
e165	1,3-dinitrobenzene	View
e172	1,4-dinitrobenzene	View
e177	triphenyl phosphite	View
e190	4-nonylphenol	View
e191	4-chlorobenzaldehyde	View
e196	paradichlorobenzene	View
e197	4-chloroaniline	View
e202	1,3-dibromobenzene	View
e203	3-chloroaniline	View
e214	phenol	View
e219	n-[2-(octadecanoylamino)ethyl]octadecanamide	View
e222	morpholine	View
e238	n-ethyl-1-naphthalenamine	View
e240	2,4,6-tribromophenol	View
e243	pyridafenthion	View
e246	(4-chlorophenyl)-phenylmethanol	View
e251	[[4-(benzoyloxyimino)-1-cyclohexa-2,5-dienylidene]amino] benzoate	View
e252	thiuram mt	View
e254	2,2'-dibenzothiazyl disulfide	View
e257	2,4-dinitrotoluene	View
e260	malathion	View
e264	simazine	View
e288	thiram	View
e301	disulfoton sulfone	View
e302	disulfoton sulfoxide	View
e303	disulfoton	View
e304	dibenz(a,h)acridine	View
e305	fenthoate	View
e307	diethoxy-sulfanyl-sulfanylidenephosphorane	View
e309	triclofos	View
e312	3,4-dichlorobenzotrifluoride	View
e315	diazinon	View
e323	2-(3-oxo-1h-indol-2-ylidene)-1h-indol-3-one	View
e327	nanofin	View
e332	hemimellitene	View
e335	antinonnin	View
e341	hexadecane	View
e343	3-nitrophenol	View
e349	constonate	View
e358	2,6-dinitrotoluene	View
e363	cis-1,2-cyclohexanedicarboxylic acid	View
e377	2,3,4-trichloroaniline	View
e378	1,2,3,5-tetrachlorobenzene	View
e379	3,4,5-trichloroaniline	View
e381	1,2,4,5-tetrabromobenzene	View
e382	2,4,5-trichloroaniline	View
e384	hexamethylphosphoramide	View
e386	phosmet	View
e388	3,4-dichloro-1-butene	View
e390	4-cyanophenol	View
e398	3-chlorobenzyl alcohol	View
e399	9-methyl-phenanthrene	View
e402	2,3,5,6-tetrachlorophenol	View
e403	1,2,3,4-tetrachloro-5-methoxybenzene	View
e404	benzene, 1,2,3,4-tetrachloro-5,6-dimethoxy-	View
e405	1-azacyclotridecan-2-one	View
e406	9-chlorophenanthrene	View
e407	methidathion	View
e409	simetryn	View
e413	decabromobiphenyl ether	View
e414	n,n'-dicyclohexylthiourea	View
e420	2-(1-cyclohexenyl)cyclohexanone	View
e422	trifluralin	View
e424	nereistoxin	View
e427	2,3,7,8-tetrachlorodibenzo-p-dioxin	View
e429	3,4-dichlorobenzyl alcohol	View
e431	naphthalene, 1,4-dichloro-	View
e435	chlorothalonil	View
e436	atrazine	View
e437	tartrazine	View
e438	2-isopropylnaphthalene	View
e441	4,4'-dichlorobiphenyl	View
e448	2-methylisoborneol	View
e450	2,4,2',4'-tetrachlorobiphenyl	View
e451	1,2,3,4,6,7,7-heptachlorobicyclo[2.2.1]hept-2-ene	View
e452	auramine hydrochloride	View
e459	1-octadecanethiol	View
e460	chlorpyrifos	View
e468	1,2,3,4,7,7-hexachloronorbornadiene	View
e469	benzidine orange	View
e471	9-ethyl-phenanthrene	View
e472	dimethoxy-(3-methyl-4-methylsulfinylphenoxy)-sulfanylidenephosphorane	View
e473	dimethoxy-(3-methyl-4-methylsulfonylphenoxy)-sulfanylidenephosphorane	View
e474	fenobucarb	View
e475	dioxabenzofos	View
e476	n,n'-dioctadecylurea	View
e479	2-[2,6-dibromo-4-[2-[3,5-dibromo-4-(2-hydroxyethoxy)phenyl]propan-2-yl]phenoxy]ethanol	View
e491	di-2-naphthyl disulfide	View
e492	4-ethylbiphenyl	View
e493	1,2,4-trichloro-5-methoxy-benzene	View
e494	1,4-dimethyl-2-(1-phenylethyl)-benzene	View
e495	2-[2-chloro-4-[3-chloro-4-[1,3-dioxo-1-(phenylamino)butan-2-yl]diazenylphenyl]phenyl]diazenyl-3-oxo-n-phenylbutanamide	View
e497	2,4,5-trichloro-toluene	View
e504	4-isobutylmorpholine	View
e506	decyl disulfide	View
e509	1,8-dihydroxy-4-nitro-5-(phenylamino)anthracene-9,10-dione	View
e513	kitazine	View
e514	synepirin 500	View
e515	4-methyl-2,4-bis-(p-hydroxyphenyl)pent-1-ene	View
e525	3-benzylidene camphor	View
e526	2,6-dichlorobenzenemethanol	View
e529	alachlor	View
e535	1,2,3-trichloro-4,5-dimethoxybenzene	View
e539	1,3,5-trichloro-2-nitrobenzene	View
e540	5-tert-butyl-3-(2,4-dichloro-5-propan-2-yloxyphenyl)-1,3,4-oxadiazol-2-one	View
e546	1,2-dinitrobenzene	View
e548	2,3-dinitrotoluene	View
e549	1,2,3-trichloro-4-phenylbenzene	View
e554	nonoxynol 30	View
e555	1,4-di(phenyl)benzene	View
e556	4-(2,4,6-trichlorophenoxy)aniline	View
e557	2-octyl-1,2-thiazol-3-one	View
e558	1,2,3,4,5-pentachloro-6-(2-chlorophenyl)benzene	View
e559	n,n-bis(octylphenyl)amine	View
e561	2?hydroxyethyl octacosanoate	View
e565	benthiocarb	View
e567	1,2,3,4,5,6-hexachlorobicyclo[2.2.1]hepta-2,5-diene	View
e568	heptachloronorbornene	View
e569	1-propan-2-ylnaphthalene	View
e585	2,2',4,4',5,5'-hexachlorobiphenyl	View
e587	1,3,5-tribromo-2-(2,3-dibromo-2-methylpropoxy)benzene	View
e592	1,2-diisopropyl naphthalene	View
e596	4-cyano-4'-hexylbiphenyl	View
e600	4-[(4-amino-2,3-dichlorophenyl)methyl]-2,3-dichloroaniline	View
e602	1,2,4-trichloro-3-methoxy-benzene	View
e606	2,4-dichloro-1-phenoxybenzene	View
e607	1,2,4-trichloro-5-phenoxybenzene	View
e608	2,3,4-trichloroanisole	View
e609	1,2,5-trichloro-3-methoxybenzene	View
e614	4-methylcyclohexane-1,2-dicarboxylic acid	View
e625	disperse blue143	View
e629	halmark	View
e630	3-(4-tert-butylphenyl)-2-methylpropanoic acid	View
e637	tebufenpyrad	View

10967/115 - QDB Compounds

QsarDB Repository

Piir, G.; Sild, S.; Roncaglioni, A.; Benfenati, E.; Maran, U. QSAR model for the prediction of bio-concentration factor using aqueous solubility and descriptors considering various electronic effects. SAR QSAR Environ. Res. 2010, 21, 7-8, 711-729.

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