Gramatica, P.; Giani, E.; Papa, E. Statistical external validation and consensus modeling: A QSPR case study for Koc prediction. J. Mol. Graph. Model. 2007, 25, 6, 755–766.

643 compounds | Property logKoc: logarithm of soil sorption coefficient i

ID	Name	logKoc	Details
1	formaldehyde	0.6	View
2	4,4'-DDT	5.3	View
3	Benzo[a]pyrene	5.8	View
4	4-Methoxyacetanilide	1.4	View
5	Trichlorfon	1.6	View
6	Dibenz[a,h]anthracene	6.3	View
7	Nicotine	2	View
8	Benzamide	1.5	View
9	Fenthion	3.2	View
10	Tetrachloromethane	1.9	View
11	Parathion(=ethyl parathion)	3.2	View
12	3-Methylcholanthrene	6.1	View
13	Diethylstilbestrol	4.1	View
14	Benzo[a]anthracene	5.4	View
15	Urea	1	View
16	Propyleneglycol	0.4	View
17	7,12-Dimethylbenz[a]anthracene	5.4	View
18	Lindane	3	View
19	2,3,4,6-Tetrachlorophenol	3.4	View
20	p-(Phenylazo)aniline	2.8	View
21	4-Dimethylaminoazobenzene	3.9	View
22	2-Phenylethanol	1.5	View
23	Dimethoate	1.1	View
24	Dieldrin	4.4	View
25	Amitrol	1.6	View
26	4-Nitrobenzoic acid	1.5	View
27	Aniline	1.4	View
28	Thioacetamide	0.8	View
29	Thiourea	0.9	View
30	Dichlorvos	1.7	View
31	Carbaryl	2.4	View
32	3-Methylphenylurea	1.6	View
33	Phenylurea	1.4	View
34	Ethanol	0.2	View
35	Acetic Acid	0	View
36	Benzoic Acid	1.5	View
37	Methanol	0.4	View
38	Trichloromethane	1.7	View
39	Hexachloroethane	3.3	View
40	1-Propanol	0.5	View
41	1-Butanol	0.5	View
42	1-Pentanol	0.7	View
43	Benzene	1.9	View
44	1,1,1-Trichloroethane	2	View
45	Endrin	4.1	View
46	Methoxychlor	4.9	View
47	4,4-DDD	4.8	View
48	4,4'-DDE	4.8	View
49	Methyl bromide	1.3	View
50	Dichloromethane	1.4	View
51	Ethylene Oxide	0.3	View
52	Tribromomethane	2.2	View
53	Bromodichloromethane	1.8	View
54	1,1-Dichloroethane	1.5	View
55	1,1-Dichloroethene	1.8	View
56	Trichlorofluoromethane	2.2	View
57	Dalapon	0.4	View
58	Chloropicrin	1.8	View
59	Heptachlor	4	View
60	Hexachlorocyclopentadiene	3.2	View
61	Tribuphos	3.7	View
62	Isophorone	1.4	View
63	1,2-Dichloropropane	1.7	View
64	1,1,2-Trichloroethane	1.8	View
65	Trichloroethene	2	View
66	1,1,2,2-Tetrachloroethane	1.9	View
67	Warfarin	3	View
68	1-Amino-2-methyl-9,10-Anthracenedione	3.9	View
69	Pentachloronitrobenzene	4.6	View
70	Acenaphthene	3.9	View
71	9,10-Anthracenedione	3.6	View
72	Diethyl phthalate	1.8	View
73	Diisobutyl phthalate	3.1	View
74	Di-n-butyl phthalate	3.1	View
75	Di-n-hexyl phthalate	4.7	View
76	Phenanthrene	4.3	View
77	Benzo[f]quinoline	4.8	View
78	Pentabromoethylbenzene	4.9	View
79	Fenac	1.6	View
80	1,3-Isobenzofurandione	1.6	View
81	n-Butyl benzyl phthalate	3.7	View
82	2-Butoxy-2-oxoethyl butyl phthalate	3.7	View
83	N-Nitrosodiphenylamine	3.1	View
84	Azinphos methyl	2.6	View
85	Fluorene	3.7	View
86	Carbazole	3.7	View
87	1-Naphthalene acetamide	2	View
88	1-Naphthalene acetic acid	2.3	View
89	1,2,3-Trichlorobenzene	3.3	View
90	Pentachlorophenol	3.3	View
91	2,4,6-Trichlorophenol	3	View
92	2-Nitrophenol	2.1	View
93	Dinoseb	2.4	View
94	Phthalic acid	1.1	View
95	2-Methoxyphenol	1.6	View
96	1-Methylnaphthalene	3.4	View
97	1-Naphthol	3	View
98	4,4'-Bis(dimethylamino)benzophenone	2.2	View
99	Diphenylmethanol	2.3	View
100	1,2-Dimethoxybenzene	2	View
101	Naphthalene	3.1	View
102	Quinoline	3	View
103	2-Methylnaphthalene	3.5	View
104	N,N-Diethyl Aniline	2.4	View
105	Methapyrilene	2.9	View
106	3,3'-Dichlorobenzidine	4.4	View
107	Tetracene	5.8	View
108	Biphenyl	3.3	View
109	Phenazine	3.4	View
110	Benzidine	3.5	View
111	4-Acetylbiphenyl	3.2	View
112	2-Acetonaphthalene	2.9	View
113	Methyl benzoate	2.1	View
114	Silvex	2.5	View
115	2,4,5-T acid	1.9	View
116	Ethyl benzoate	2.3	View
117	Phenyl Benzoate	3.2	View
118	Ethyl 4-methylbenzoate	2.6	View
119	Safrole	2.8	View
120	MCPA	1.7	View
121	2,4-D acid	1.5	View
122	Benzotriazole	1.7	View
123	Benzo[b]thiophene	3.5	View
124	1,2-Dimethylbenzene	2.4	View
125	o-cresol	1.3	View
126	2-Chlorotoluene	2.6	View
127	1,2-Dichlorobenzene	2.5	View
128	2-Chlorophenol	2.2	View
129	1,3,4-Trimethylbenzene	3.6	View
130	3,4-Dichloroaniline	2.3	View
131	3,4-Dichlorophenol	3.1	View
132	1,2,4,5-Tetramethylbenzene	3.1	View
133	1,2,4,5-Tetrachlorobenzene	3.2	View
134	2,4,5-Trichlorophenol	3	View
135	1,2-Dibromo-3-chloropropane	2	View
136	3-Trifluoromethylaniline	2.4	View
137	alpha-Methylbenzyl alcohol	1.5	View
138	Acetophenone	1.6	View
139	Nitrobenzene	2.1	View
140	Amino-3-nitrobenzene	1.7	View
141	Dichloran	3.4	View
142	3,5-Dinitrobenzoic acid	1.9	View
143	Trinitrobenzol i	1.3	View
144	3,4-Dichloronitrobenzene	2.5	View
145	m-Dinitrobenzene	1.6	View
146	Ethyl 4-nitrobenzoate	2.5	View
147	4-Methylbenzoic acid	1.8	View
148	4-Hydroxybenzoic Acid	1.4	View
149	Amino-4-nitrobenzene	1.9	View
150	4-Nitrophenol	2.1	View
151	Ethylbenzene	2.3	View
152	Styrene	3	View
153	Benzyl alcohol	0.7	View
154	3-Cyanopyridine	1.7	View
155	N-methylaniline	2.3	View
156	Anisole	1.5	View
157	Anilazine	3.2	View
158	Chlorpropham	2.7	View
159	Fenuron	1.4	View
160	4,4'-Methylenebis(N,N-Dimethylaniline)	4	View
161	4,4'Methylene dianiline	2	View
162	Diphenyl ether	3.3	View
163	Ethyl Phenylacetate	1.9	View
164	Ethyl-N-phenylcarbamate	1.8	View
165	1,3,5-Triethylbenzene	4.1	View
166	Bis(2-ethylhexyl) adipate	4.2	View
167	Azobenzene	3.2	View
168	Propylbenzene	2.9	View
169	2-Pyridineethanol	1.5	View
170	Phenylacetic Acid	1.5	View
171	Acetanilide	1.4	View
172	4-Bromoacetanilide	2	View
173	n-Butylbenzene i	3.4	View
174	Ethyl heptanoate	2.6	View
175	Ethyl octanoate	3	View
176	4-Bromoaniline	2	View
177	4-Bromophenol	2.4	View
178	1,4-Dimethylbenzene	2.5	View
179	4-Methylphenol	2.2	View
180	1,4-Dichlorobenzene	2.5	View
181	4-Chloroaniline	2	View
182	4-Chlorophenol	1.9	View
183	4-Methylaniline	1.9	View
184	Epichlorohydrin	1	View
185	1,2-Dibromoethane	1.7	View
186	2-Propenal	-0.3	View
187	1,2-Dichloroethane	1.5	View
188	1,3-Dimethylbenzene	2.8	View
189	m-Cresol	1.5	View
190	3-Chlorophenol	2.2	View
191	3-Methylaniline	1.7	View
192	3-Hydroxyphenol	1	View
193	Bis(2-chloroisopropyl)ether	1.7	View
194	1,3,5-Trimethylbenzene	2.8	View
195	3,5-Dimethylphenol	2.8	View
196	1,3,5-Trichlorobenzene	2.9	View
197	Bromobenzene	2.3	View
198	Toluene	2.2	View
199	Chlorobenzene	2.4	View
200	Phenol	1.4	View
201	n-Butylamine	1.9	View
202	1-Hexanol	1	View
203	Bis(2-chloroethyl)ether	1.5	View
204	1-Heptanol	1.1	View
205	1-Octanol	1.6	View
206	1-Decanol	2.6	View
207	1-Dodecanol	3.5	View
208	Propoxur	1.5	View
209	2-Chlorophenylurea	1.6	View
210	Chlorendic acid	2.8	View
211	Endosulfan	4.1	View
212	Dicofol	3.7	View
213	Fensulfothion	2.5	View
214	Aldicarb	1.6	View
215	2,3,5,6-Tetrachloronitrobenzene	4.1	View
216	Di-2-ethylhexyl phthalate	5	View
217	bis(n-octyl) Phthalate	4.4	View
218	Hexachlorobenzene	3.8	View
219	Chloranil	2.3	View
220	2,4,6-Trinitrotoluene	2.7	View
221	Benzophenone	2.7	View
222	2,2'-Biquinoline	4	View
223	Anthracene	4.3	View
224	Dichloroprop	3	View
225	Ethyl 4-hydroxybenzoate	2.2	View
226	Catechol	2.1	View
227	1,2,4-Trichlorobenzene	3.1	View
228	2,4-Dichlorophenol	2.8	View
229	N,N-Dimethylaniline	2.3	View
230	Malathion	2.7	View
231	3,5-Dinitrobenzamide	2.3	View
232	Fenitrothion	2.6	View
233	3-Nitroacetanilide	1.9	View
234	Simazine	2.1	View
235	Diphenylamine	2.8	View
236	Propham	1.8	View
237	1,2-Diphenylhydrazine	3	View
238	Maleic hydrazine	0.5	View
239	Ethyl hexanoate	2.1	View
240	1,4-Dioxane	1.2	View
241	Chlorodibromomethane	1.9	View
242	Tetrachloroethene	2.5	View
243	Dibenzo[a,h]pyrene-7,14-dione	4.3	View
244	Pyrene	4.8	View
245	Dimethyl phthalate	2	View
246	Dibenzofuran	3.9	View
247	Dibenzothiophene	4.1	View
248	Captan	2.3	View
249	Folpet	3.3	View
250	Chloramben i	1.4	View
251	1-Aminonaphthalene	3.5	View
252	Thiram	2.8	View
253	Propazine	2.3	View
254	4,4'-Thiodianiline	2	View
255	Dicrotophos(cis)	1.7	View
256	Hexanoic Acid	1.5	View
257	1-Nonanol	1.9	View
258	Chlordecone	4.2	View
259	Endothal	2.1	View
260	Thiabendazole	3.2	View
261	2-Benzothiazolethiol	2.3	View
262	4-Aminobenzoic acid	2.1	View
263	3-Methoxyphenol	1.5	View
264	Monuron	2	View
265	4-Methoxyphenol	1.8	View
266	Aziridine	0.8	View
267	trans-1,2-Dichloroethene	1.8	View
268	Dibenzo[a,i]pyrene	5.7	View
269	Benzo[g,h,i]perylene	5.4	View
270	Benzo[e]pyrene	6.1	View
271	Indeno[1,2,3-cd]pyrene	6.3	View
272	7H-Dibenzo[c,g]carbazole	6	View
273	Perylene	5.5	View
274	Benzo[b]fluoranthene	5.4	View
275	Fluoranthene	4.7	View
276	Benzo[k]fluoranthene	5	View
277	Acenaphthylene	3.8	View
278	Chrysene	5.5	View
279	Dibenz[a,j]anthracene	6	View
280	Benz[a]acridine	4.4	View
281	Benzo[a]fluorene	5.5	View
282	13H-Dibenzo[a,i]carbazole	6	View
283	Acridine	4.1	View
284	Parathion methyl	3	View
285	Phorate	3.1	View
286	Disulfoton	3.1	View
287	Naled	2.2	View
288	Oxydemeton-Methyl	1.1	View
289	Aldrin	4.4	View
290	Bromacil	1.7	View
291	Isocil	2.1	View
292	alpha-HCH	3.3	View
293	beta-HCH	3.4	View
294	3-(3-Fluorophenyl)-1,1-dimethylurea	1.7	View
295	Diuron	2.5	View
296	Linuron	2.8	View
297	3-(4-Fluorophenyl)-1,1-dimethylurea	1.4	View
298	Diazinon	2.8	View
299	trans-Mevinphos	2	View
300	3-Fluoroacetanilide	1.6	View
301	3-Trifluoromethylacetanilide	1.8	View
302	4-Fluoroacetanilide	1.5	View
303	2,2'-Bipyridine	1.6	View
304	Auramine base i	3.3	View
305	Indane	3.6	View
306	Chlorobenzilate	3.4	View
307	1,2,3-Trimethylbenzene	2.8	View
308	Pentachloroaniline	4.6	View
309	3,4-Dinitrobenzoic Acid	1.5	View
310	o-Chloroacetanilide i	1.6	View
311	3-Methylacetanilide	1.5	View
312	Ethyl pentanoate	2	View
313	1,3-Dichlorobenzene	2.5	View
314	1,3-Dichloropropene	1.5	View
315	2,4-Dichloroaniline	2.7	View
316	3-Nitrophenol	1.7	View
317	Neburon	3.4	View
318	Methyl Isothiocyanate	1	View
319	Ethion	4.1	View
320	2,3-Dichlorophenol	2.7	View
321	2,3-dimethylnaphthalene	4.1	View
322	4-Bromonitrobenzene	2.4	View
323	3-(3-Chlorophenyl)-1,1-dimethylurea	1.8	View
324	2-Chloroacetanilide i	1.6	View
325	3-Chloroacetanilide	1.9	View
326	3,5-Dichlorophenol	2.8	View
327	Iodobenzene	3.1	View
328	Dibromodichloromethane	1.9	View
329	Trichloroacetamide	1	View
330	Methyl-urea	1.8	View
331	2,6-Dichloroaniline	3.3	View
332	Pentachlorobenzene	4.4	View
333	3,4,5-Trichlorophenol	3.6	View
334	2-Chlorobenzamide	1.5	View
335	2-Nitrobenzamide	1.5	View
336	N,N-Dimethylbenzamide	1.5	View
337	2-Aminoanthracene	4.5	View
338	N-Methylbenzamide	1.4	View
339	Ethyl 3,5-dinitrobenzoate	2.7	View
340	3,5-Dinitroaniline	2.6	View
341	4-Methylbenzamide	1.8	View
342	4-Nitrobenzamide	1.9	View
343	3-Bromoacetanilide	2	View
344	4-Ethyltoluene	3.6	View
345	3,5-Dichloroaniline	2.4	View
346	1,1,1,2-Tetrachloroethane	1.7	View
347	Tetrachlorophthalic acid i	3.3	View
348	1,2,3,4-Tetrachlorobenzene	3.8	View
349	2,3,4-Trichloroaniline	2.6	View
350	2,3,4,5-Tetrachloroaniline	3	View
351	1,2,3,5-Tetrachlorobenzene	3.4	View
352	3-Nitrobenzamide	2	View
353	Pentafluorophenyl methyl sulfone	1.5	View
354	2-Fluorophenylurea	1.3	View
355	4-Fluorophenylurea	1.5	View
356	Simatone	2.3	View
357	N,N-Diethylacetamide i	1.8	View
358	2,3,5-Trimethylphenol	3.6	View
359	Propanil	2.2	View
360	Anthracene-9-carboxylic acid	2.7	View
361	Phosmet	2.9	View
362	Bensulide	3.5	View
363	EPTC	2.4	View
364	3-Fluorophenylurea	1.8	View
365	9-Methylanthracene	4.8	View
366	9-Acetylanthracene	3.6	View
367	Carbophenothion	4.7	View
368	Cyclohexylbenzene	4.2	View
369	Ametryn	2.6	View
370	1-Phenylazo-2-naphthalenol	3.6	View
371	2,3,4,5-Tetrachloronitrobenzene	4.2	View
372	Terbutryn	2.9	View
373	3-Phenyl-1-cyclohexylurea	2.1	View
374	Demeton-S-methyl	1.5	View
375	2,3,5-Trichlorophenol	3.6	View
376	2-Ethylnaphthalene	3.8	View
377	Fonofos	3.3	View
378	Methidathion	2	View
379	Carbophenothion-methyl	4.7	View
380	Diphenamid	2.1	View
381	Stirofos	3.1	View
382	3-Phenyl-1-methylurea	1.3	View
383	Heptachlor epoxide	4	View
384	Pebulate	2.8	View
385	1-Ethylnaphthalene	3.8	View
386	Butyranilide	1.7	View
387	Cycloate	2.5	View
388	Dichlobenil	2.4	View
389	Tetrachlorocatechol	1.6	View
390	9-Anthracenemethanol	3.6	View
391	5-Indanol	3.6	View
392	Butyl-N-phenylcarbamate	2.3	View
393	Carbofuran	1.6	View
394	Trifluralin	4.2	View
395	Atratone	2.6	View
396	Prometon	2.6	View
397	N,N'-Diethylhydrazine	1.2	View
398	Aldicarb sulfoxide	0.6	View
399	Aldicarb sulfone (=aldoxycarb)	0.7	View
400	Bromoxynil	2.3	View
401	Bromoxynil octanoate	4	View
402	Pyrazon	2.1	View
403	Monolinuron	2.2	View
404	Diamidafos	1.5	View
405	Nitrofen	3.7	View
406	Chlornitrofen	3.9	View
407	Dimethyl 2,3,5,6-Tetrachloroterephthalate	3.7	View
408	Benfluralin	4	View
409	Chlorothalonil	3.2	View
410	Atrazine	2.2	View
411	Ipazine	3.1	View
412	Trietazine	2.8	View
413	Dicamba	1.5	View
414	Picloram	1.3	View
415	Chlorthiamid	2.3	View
416	Propachlor	2.4	View
417	Methyl 3,4-dichlorophenylcarbamate	2.7	View
418	Vernolate	2.4	View
419	Nitrapyrin	2.6	View
420	Methyl N-phenylcarbamate i	1.7	View
421	Chlorbufam	2.2	View
422	4-Bromophenylurea	2.1	View
423	3-Chlorophenylurea	2	View
424	Chloroxuron	3.5	View
425	Siduron	2.5	View
426	Butylate	2.9	View
427	2,6-Dichlorobenzamide	0.5	View
428	Methiocarb	2.3	View
429	4,4'-Dichlorobiphenyl	4.3	View
430	2-Chlorobiphenyl	3.5	View
431	3-Chlorobiphenyl	4.4	View
432	2,6-dinitro-N-(n-propyl)-alpha, alpha, alpha-trifluoro-p-toluidine	3.6	View
433	EPN	3.1	View
434	Ethyl 1-naphthaleneacetate	2.5	View
435	2,3,5,6-Tetrachloroterephthalic acid	3.5	View
436	3,4-Dichloroacetanilide	2.3	View
437	Hydroxyatrazine	3	View
438	Fluometuron	2	View
439	Molinate	1.9	View
440	Octachloronaphthalene	5.9	View
441	Diallate	3.3	View
442	Triallate	3.4	View
443	Pentanochlor	2.8	View
444	Phosalone	3	View
445	Propargite	3.6	View
446	3,4-Dichlorophenylurea	2.5	View
447	Mirex	6	View
448	Xylylcarb i	1.7	View
449	Benzaloxime-N-methylcarbamate i	1.8	View
450	Oxythioquinox	3.4	View
451	Tetrachloroguaiacol	2.9	View
452	Etridiazole	3	View
453	6-Aminochrysene	5.2	View
454	4,5,6-Trichloroguaiacol	2.9	View
455	1,4-Dichloro-2,5-dimethoxybenzene	3.1	View
456	Trimethacarb i	2.6	View
457	Chlorpyrifos	3.9	View
458	Captafol	3.3	View
459	Clopidol	2.8	View
460	3-Bromophenylurea	2.1	View
461	Metobromuron	2.1	View
462	Fensulfothion sulfide	3.2	View
463	Tetrapropyl dithiopyrophosphate	3.8	View
464	Asulam	2	View
465	Temephos	5	View
466	Pipron	3.7	View
467	2,3,5,6-Tetrachloroaniline	3.9	View
468	3-(3,4-Dichlorophenyl)-1-methylurea	2.5	View
469	4-Biphenylmethanol	2.6	View
470	TEDP	2.7	View
471	Fenobucarb	1.7	View
472	Metizolin	1.5	View
473	Methyl N-(3-chlorophenyl)carbamate i	2.2	View
474	Dipropetryn	3.1	View
475	6-Chloropicolinic acid	1.2	View
476	Nitralin	2.9	View
477	1-Naphthalenemethanol	2.3	View
478	Carboxin	2.4	View
479	Oxycarboxin	1.7	View
480	3-Chloro-4-methoxyaniline	1.9	View
481	Propyl-N-phenylcarbamate	2.1	View
482	Chlorpyrifos methyl	3.5	View
483	Terbacil	1.7	View
484	Terbuthylazine	2.3	View
485	Bis(2-ethylhexyl) terephthalate	4.2	View
486	3,5,6-trichloro-2-pyridinol	2.1	View
487	Monocrotophos	0	View
488	3-Methyl-4-bromoaniline	2.3	View
489	2,4,4'-Trichlorobiphenyl	4.6	View
490	3'-Chloro-4'-methoxyacetanilide	2	View
491	Mecoprop	1.3	View
492	Pyroxychlor	3.5	View
493	3-(4-Methylphenyl)-1,1-dimethylurea	1.5	View
494	3-(4-Methoxyphenyl)-1,1-dimethylurea	1.4	View
495	Chloramben methyl	2.7	View
496	Prometryn	2.9	View
497	Crotoxyphos(trans)	2	View
498	Mevinphos(cis)	2	View
499	Toxaphene	3.1	View
500	trans-1,3-Dichloropropene	1.4	View
501	Methamidophos	0.7	View
502	Terbufos sulfoxide	2.2	View
503	Carbendazim (MBC)	2.4	View
504	Ancymidol	2.1	View
505	2,2'-Dichlorobiphenyl	3.9	View
506	Terbufos	2.8	View
507	3-Trifluoromethylphenylurea	2	View
508	3-Phenyl-1-cyclopropylurea	1.7	View
509	3-Phenyl-1-cyclopentylurea	1.9	View
510	Phosphamidon	0.9	View
511	Ethoprophos	1.8	View
512	Chlorbromuron	2.7	View
513	Desmedipham	3.2	View
514	Phenmedipham	3.4	View
515	Fensulfothion sulfone	2.2	View
516	Napropamide	2.7	View
517	Chlorotoluron	2	View
518	2,2',6,6'-Tetrachlorobiphenyl	5	View
519	Alachlor	2.3	View
520	Methomyl	1.8	View
521	Benomyl	2.7	View
522	Methyl N-(3,4-dichlorophenyl)carbamate i	2.7	View
523	Methabenzthiazuron	2.8	View
524	Chlorfenvinphos(trans)	2.5	View
525	Chlorfenvinphos(cis)	2.5	View
526	Oryzalin	3.1	View
527	Oxadiazon	3.5	View
528	Metoxuron	1.7	View
529	Methazole	3.5	View
530	3-(3-Chloro-4-methoxylphenyl)-1-methylurea	1.8	View
531	3-(3-Chlorophenyl)-1-methylurea	1.9	View
532	Metribuzin	1.9	View
533	Leptophos	4.2	View
534	Cyanazine	2.3	View
535	3-(3-Chloro-4-methylphenyl)-1-methylurea	2.1	View
536	Fenamiphos	2.5	View
537	Bendiocarb	2.8	View
538	Pirimicarb(=Pirimor)	2.1	View
539	Oxamyl	1	View
540	Butachlor	3.1	View
541	Thiophanate-methyl	3.3	View
542	Pronamide	2.3	View
543	Piperophos	3.4	View
544	Bentazon	1.5	View
545	3-Chloro-4-methoxyphenylurea	2	View
546	Isofenphos	2.8	View
547	Iprobenfos	2.4	View
548	Ethofumesate	2.1	View
549	Secbumeton	2.8	View
550	Chlornidine	3.9	View
551	Profluralin	4	View
552	Triforine	2.8	View
553	Norflurazon	3.3	View
554	3-(3-Methoxyphenyl)-1,1-dimethylurea	1.7	View
555	Thiobencarb	3.3	View
556	Dinitramine	3.6	View
557	Pirimiphos-methyl	3	View
558	3-Chloro-4-bromonitrobenzene	2.6	View
559	Acephate	0.4	View
560	Fenamiphos Sulfoxide	1.6	View
561	Fenamiphos Sulfone	1.6	View
562	2,4-DB butoxyethyl ester	2.7	View
563	2,3',4',5-Tetrachlorobiphenyl	4.9	View
564	Fluchloralin	3.6	View
565	Butralin	4	View
566	Isopropalin	4	View
567	Tebuthiuron	1.8	View
568	Isoproturon	2.1	View
569	Acetochlor	2.2	View
570	2,4'-Dichlorobiphenyl	4.1	View
571	2,2',4,4',5,5'-Hexachlorobiphenyl	5.9	View
572	Diflubenzuron	3.8	View
573	Sulprofos	4.3	View
574	Imazalil	3.7	View
575	2,2',5,5'-Tetrachlorobiphenyl	4.8	View
576	Hexabromobiphenyl i	4.9	View
577	3-(3,5-Dimethylphenyl)-1,1-dimethylurea	1.7	View
578	Iprodione	2.2	View
579	2,5,2'-Trichlorobiphenyl	4.2	View
580	2,4,2'-Trichlorobiphenyl	4.8	View
581	2,2',4,5,5'-Pentachlorobiphenyl	4.6	View
582	2,2',3,4,5'-Pentachlorobiphenyl	4.7	View
583	2,2',3,3',4,4'-Hexachlorobiphenyl	5.7	View
584	Diethatyl-Ethyl	3.1	View
585	Pendimethalin	3	View
586	Profenofos	3	View
587	Metamitron	2.2	View
588	Tricyclazole	3.1	View
589	Isazophos	2	View
590	Bifenox	3.7	View
591	Oxyfluorofen	4.9	View
592	Triadimefon	2.6	View
593	Metolachlor	2.5	View
594	Hexazinone	1.7	View
595	Diclofop-Methyl	4.2	View
596	Fenvalerate	4.4	View
597	Thidiazuron	2	View
598	Cypermethrin	4.6	View
599	Permethrin	4	View
600	2,2',3,4,5,5'-Hexachlorobiphenyl	6	View
601	2,2',3,4,5,5',6-Heptachlorobiphenyl	5.8	View
602	Ethalfluralin	3.8	View
603	Dimethipin	0.5	View
604	Triclopyr	1.6	View
605	Isouron	2.5	View
606	Terbufos sulfone	2.2	View
607	Metalaxyl	1.6	View
608	Tridiphane	3.8	View
609	Thiodicarb	2.5	View
610	Fluridone	2.8	View
611	Fenarimol	3	View
612	Propiconazole	3.4	View
613	Fluorochloridone	2.6	View
614	Flumetralin	4	View
615	Pentyl-N-phenylcarbamate	2.6	View
616	Chlorosulfuron	1.6	View
617	Cyromazine	2.3	View
618	Esfenvalerate	3.7	View
619	Fenoxaprop-Ethyl	4	View
620	Tralomethrin	5	View
621	Prochloraz	2.7	View
622	Cyfluthrin	5	View
623	Fluazifop-butyl	2.8	View
624	Flucythrinate	5	View
625	4-Chlorobenzaloxime-N-methylcarbamate i	2	View
626	Sethoxydim	2	View
627	Sulfometuron methyl	1.8	View
628	Metsulfuron methyl i	1.7	View
629	Quizalofop-ethyl	2.7	View
630	Flutriafol	1.9	View
631	3-(3,5-Dimethyl-4-bromophenyl)-1,1-dimethylurea	2.5	View
632	4-Phenoxylphenylurea	2.6	View
633	3-Methyl-4-fluorophenylurea	1.8	View
634	3-Methyl-4-bromophenylurea	2.4	View
635	Hexythiazox	3.8	View
636	Fenoxycarb	3	View
637	Thiameturon-methyl	1.7	View
638	Imazapyr i	2	View
639	Isoxaben	2.4	View
640	Bifenthrin	5.4	View
641	Cinmethylin	2.6	View
642	Chlorimuron ethyl	2	View
643	Cyhalothrin i	5.3	View

Bibliography

Sabljić, A.; Güsten, H.; Verhaar, H.; Hermens, J. QSAR modelling of soil sorption. Improvements and systematics of log KOC vs. log KOW correlations. Chemosphere 1995, 31, 4489–4514. https://doi.org/10.1016/0045-6535(95)00327-5
Tao, S.; Piao, H.; Dawson, R.; Lu, X.; Hu, H. Estimation of Organic Carbon Normalized Sorption Coefficient (Koc) for Soils Using the Fragment Constant Method . Environ. Sci. Technol. 1999, 33, 2719–2725. https://doi.org/10.1021/es980833d
Huuskonen, J. Prediction of Soil Sorption Coefficient of a Diverse Set of Organic Chemicals From Molecular Structure. J. Chem. Inf. Model. 2003, 43, 1457–1462. https://doi.org/10.1021/ci020342j

10967/135 - QDB Compounds

QsarDB Repository

Gramatica, P.; Giani, E.; Papa, E. Statistical external validation and consensus modeling: A QSPR case study for Koc prediction. J. Mol. Graph. Model. 2007, 25, 6, 755–766.

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