Schultz, T.W.; Hewitt, M.; Netzeva, T.I.; Cronin, M.T.D. Assessing Applicability Domains of Toxicological QSARs: Definition, Confidence in Predicted Values, and the Role of Mechanisms of Action. QSAR Comb. Sci. 2007, 26, 2, 238–254.

501 compounds | Property MOA: Mode of action

ID	Name	MOA	Details
1	3-Aminobenzyl alcohol	Narcotic	View
2	2-Aminobenzyl alcohol	Narcotic	View
3	Benzyl alcohol	Narcotic	View
4	4-Hydroxyphenethyl alcohol	Narcotic	View
5	4-Aminobenzyl cyanide	Non-narcotic	View
6	2-Nitrobenzamide	Non-narcotic	View
7	4-Hydroxy-3-methoxybenzyl alcohol	Narcotic	View
8	2-Anisidine	Narcotic	View
9	(sec)Phenethyl alcohol	Narcotic	View
10	Resorcinol	Narcotic	View
11	1-Phenyl-2-propanol	Narcotic	View
12	Phenethyl alcohol	Narcotic	View
13	2-Phenyl-2-propanol	Narcotic	View
14	3-Amino-2-cresol	Narcotic	View
15	2,4,6-Tris(dimethylaminomethyl)phenol	Narcotic	View
16	4-Methylbenzyl alcohol	Narcotic	View
17	Phenylacetic acid hydrazide	Non-narcotic	View
18	3-Cyanoaniline	Narcotic	View
19	Acetophenone	Narcotic	View
20	2-Methylbenzyl alcohol	Narcotic	View
21	(+/-)1-Phenyl-1-propanol	Narcotic	View
22	2,3-Dimethylaniline	Narcotic	View
23	2,6-Dimethylaniline	Narcotic	View
24	n-Methylphenethylamine	Narcotic	View
25	2-Methyl-1-phenyl-2-propanol	Narcotic	View
26	2-Phenyl-1-propanol	Narcotic	View
27	3-Fluorobenzyl alcohol	Narcotic	View
28	4-Hydroxybenzyl cyanide	Narcotic	View
29	4-Cyanobenzamide	Narcotic	View
30	2-Fluoroaniline	Narcotic	View
31	Benzyl cyanide	Narcotic	View
32	3,5-Dimethylaniline	Narcotic	View
33	Phenol	Narcotic	View
34	2,5-Dimethylaniline	Narcotic	View
35	3-Methoxyphenol	Narcotic	View
36	2-Cresol	Narcotic	View
37	2,4-Dimethylaniline	Narcotic	View
38	β-Methylphenethylamine	Narcotic	View
39	3-Methylaniline	Narcotic	View
40	4-Methylphenethyl alcohol	Narcotic	View
41	Benzylamine	Narcotic	View
42	3-Methylbenzyl alcohol	Narcotic	View
43	2-Tolunitrile	Narcotic	View
44	Aniline	Narcotic	View
45	3-Nitrobenzyl alcohol	Narcotic	View
46	2-Ethylaniline	Narcotic	View
47	3-Phenyl-1-propanol	Narcotic	View
48	Benzaldehyde	Narcotic	View
49	(+/-)-α-Methylbenzylamine	Narcotic	View
50	2-Phenyl-3-butyn-2-ol	Non-narcotic	View
51	2-Chloroaniline	Narcotic	View
52	Hydrocinnamonitrile	Non-narcotic	View
53	(+/-)-α-Ethylphenethyl alcohol	Narcotic	View
54	4-Cresol	Narcotic	View
55	2-Methylaniline	Narcotic	View
56	3,4-Dimethylaniline	Narcotic	View
57	3-Acetamidophenol	Narcotic	View
58	4-Methoxyphenol	Narcotic	View
59	Isovanillin	Narcotic	View
60	Phenetole	Narcotic	View
61	Chlorobenzene	Narcotic	View
62	Benzene	Narcotic	View
63	syn-Benzaldehyde oxime	Non-narcotic	View
64	β-Ethylphenethyl alcohol	Narcotic	View
65	2,4,5-Trimethoxybenzaldehyde	Narcotic	View
66	Anisole	Narcotic	View
67	3-Fluoroaniline	Narcotic	View
68	3,5-Dimethoxyphenol	Narcotic	View
69	(s+/-)-1-Phenyl-1-butanol	Narcotic	View
70	Cinnamyl alcohol	Narcotic	View
71	3-Cresol	Narcotic	View
72	2-Nitroanisole	Narcotic	View
73	α,α-Dimethylbenzenepropanol	Narcotic	View
74	Propiophenone	Narcotic	View
75	2,4,6-Trimethylaniline	Narcotic	View
76	4-Methylaniline	Narcotic	View
77	2-(4-tolyl)Ethylamine	Narcotic	View
78	3-Ethylaniline	Narcotic	View
79	Vanillin	Narcotic	View
80	4-Hydroxy-3-methoxybenzonitrile	Narcotic	View
81	Ethyl phenylcyanoacetate	Narcotic	View
82	4-Methyl benzylamine	Narcotic	View
83	(R+/-)-1-Phenyl-1-butanol	Narcotic	View
84	Thioacetanilide	Non-narcotic	View
85	α-Methylbenzyl cyanide	Narcotic	View
86	3-Phenyl-1-butanol	Narcotic	View
87	4-Ethoxyphenol	Narcotic	View
88	3-Ethoxy-4-hydroxybenzaldehyde	Narcotic	View
89	4-Fluorophenol	Narcotic	View
90	3-Nitroaniline	Narcotic	View
91	4-Ethylaniline	Narcotic	View
92	4-Chloroaniline	Narcotic	View
93	n-Methylaniline	Narcotic	View
94	Benzyl chloride	Narcotic	View
95	(+/-)-2-Phenyl-2-butanol	Narcotic	View
96	4-Ethylbenzyl alcohol	Narcotic	View
97	n-Ethylaniline	Narcotic	View
98	2-Propylaniline	Narcotic	View
99	2-Nitroaniline	Non-narcotic	View
100	Bromobenzene	Narcotic	View
101	3-Hydroxybenzaldehyde	Narcotic	View
102	Thiobenzamide	Non-narcotic	View
103	1-Fluoro-4-nitrobenzene	Non-narcotic	View
104	4-Methoxybenzonitrile	Narcotic	View
105	2-Bromobenzyl alcohol	Narcotic	View
106	3-Nitrobenzaldehyde	Non-narcotic	View
107	3,5-Dimethylphenol	Narcotic	View
108	4’-Hydroxypropiophenone	Narcotic	View
109	2-Isopropylaniline	Narcotic	View
110	2,3-Dimethylphenol	Narcotic	View
111	3,4-Dimethylphenol	Narcotic	View
112	4-Phenyl-1-butanol	Narcotic	View
113	4-Chlororesorcinol	Narcotic	View
114	2(4-Chlorophenyl)ethylamine	Narcotic	View
115	2,5-Dimethylphenol	Narcotic	View
116	Nitrobenzene	Narcotic	View
117	2,4-Dimethylphenol	Narcotic	View
118	4-Phenylbutyronitrile	Narcotic	View
119	2-Anisaldehyde	Narcotic	View
120	3-Chlorobenzyl alcohol	Narcotic	View
121	(+/-)-1-Phenyl-2-pentanol	Narcotic	View
122	2-Ethylphenol	Narcotic	View
123	4-Chlorobenzylamine	Narcotic	View
124	Cinnamonitrile	Non-narcotic	View
125	2-Nitrobenzaldehyde	Non-narcotic	View
126	4-Isopropylbenzyl alcohol	Narcotic	View
127	Thioanisole	Narcotic	View
128	2-Chloro-4-methylaniline	Narcotic	View
129	Isophthalaldehyde	Narcotic	View
130	2-Fluorophenol	Narcotic	View
131	4-Nitrobenzaldehyde	Non-narcotic	View
132	Butyrophenone	Narcotic	View
133	4-Ethylphenol	Narcotic	View
134	3-Chloroaniline	Narcotic	View
135	4-Isopropylaniline	Narcotic	View
136	4-(Dimethylamino)benzaldehyde	Narcotic	View
137	3-Anisaldehyde	Narcotic	View
138	1-Fluoro-2-nitrobenzene	Non-narcotic	View
139	4-Chlorobenzyl alcohol	Narcotic	View
140	4-Methylanisole	Narcotic	View
141	4-Xylene	Narcotic	View
142	Toluene	Narcotic	View
143	2,4-Dihydroxyacetophenone	Narcotic	View
144	2-Nitrotoluene	Non-narcotic	View
145	Pentafluoroaniline	Non-narcotic	View
146	3-Hydroxy-4-nitrobenzaldehyde	Narcotic	View
147	2-Phenylpyridine	Narcotic	View
148	2,3,6-Trimethylphenol	Narcotic	View
149	3-Ethylphenol	Narcotic	View
150	Methyl-4-methylaminobenzoate	Narcotic	View
151	2,6-Diethylaniline	Narcotic	View
152	Benzoyl cyanide	Non-narcotic	View
153	3’-Nitroacetophenone	Narcotic	View
154	4-Chlorophenethyl alcohol	Narcotic	View
155	2,5-Difluoronitrobenzene	Non-narcotic	View
156	5-Hydroxy-2-nitrobenzaldehyde	Non-narcotic	View
157	2-Bromophenol	Narcotic	View
158	2-Allylphenol	Non-narcotic	View
159	2-Iodoaniline	Narcotic	View
160	4-Chloro-2-methylaniline	Narcotic	View
161	4-(tert.)Butylaniline	Narcotic	View
162	Iodobenzene	Narcotic	View
163	2,3,5-Trimethylphenol	Narcotic	View
164	2-Amino-4-(tert.)butylphenol	Non-narcotic	View
165	4-Methyl-2-nitroaniline	Non-narcotic	View
166	3-Chloro-2-methylaniline	Narcotic	View
167	2-Benzylpyridine	Narcotic	View
168	3-Chloro-4-methylaniline	Narcotic	View
169	Methyl-4-nitrobenzoate	Narcotic	View
170	4-Chlorobenzaldehyde	Narcotic	View
171	2,4,6-Trimethylphenol	Narcotic	View
172	(2-Bromoethyl)benzene	Narcotic	View
173	5-Phenyl-1-pentanol	Narcotic	View
174	3-Nitrotoluene	Narcotic	View
175	Salicylaldehyde	Narcotic	View
176	1-Chloro-4-nitrobenzene	Non-narcotic	View
177	Dimethylnitroterephthalate	Non-narcotic	View
178	2-Amino-5-chlorobenzonitrile	Non-narcotic	View
179	3-Nitrobenzonitrile	Non-narcotic	View
180	3-Phenylpyridine	Narcotic	View
181	4-Isopropylphenol	Narcotic	View
182	4-Bromotoluene	Narcotic	View
183	4-tert-Butylbenzyl alcohol	Narcotic	View
184	Benzhydrol	Narcotic	View
185	5-Chloro-2-methylaniline	Narcotic	View
186	3-Nitrophenol	Narcotic	View
187	2-Chloro-5-nitrobenzaldehyde	Non-narcotic	View
188	1,2-Dichlorobenzene	Narcotic	View
189	Phenyl propargyl sulfide	Non-narcotic	View
190	2-Chloro-5-methylphenol	Narcotic	View
191	4-Chlorophenol	Narcotic	View
192	2-Hydroxy-4-methoxyacetophenone	Narcotic	View
193	2,4-Dichloroaniline	Narcotic	View
194	3-Nitro-2-xylene	Narcotic	View
195	Valerophenone	Narcotic	View
196	4-Methyl-2-nitrophenol	Non-narcotic	View
197	2,5-Dichloroaniline	Narcotic	View
198	(trans)Methyl cinnamate	Narcotic	View
199	5-Methyl-2-nitrophenol	Non-narcotic	View
200	5-Chloro-2-hydroxybenzamide	Narcotic	View
201	1,2-Dimethyl-4-nitrobenzene	Narcotic	View
202	2-Bromo-4-methylphenol	Narcotic	View
203	4-Bromophenyl acetonitrile	Narcotic	View
204	4-Chloroanisole	Narcotic	View
205	2-Isopropylphenol	Narcotic	View
206	4-sec-Butylaniline	Narcotic	View
207	4-Butoxyaniline	Narcotic	View
208	3-Methyl-2-nitrophenol	Non-narcotic	View
209	3-Isopropylphenol	Narcotic	View
210	4-Hydroxy-3-nitrobenzaldehyde	Non-narcotic	View
211	5-Bromovanillin	Non-narcotic	View
212	α,α,α-Trifluoro-4-cresol	Narcotic	View
213	4-Benzylpyridine	Narcotic	View
214	Benzylidene malononitrile	Non-narcotic	View
215	4-Propylphenol	Narcotic	View
216	4-Nitrotoluene	Narcotic	View
217	3-Iodoaniline	Narcotic	View
218	Benzyl methacrylate	Narcotic	View
219	2-Nitroresorcinol	Non-narcotic	View
220	4-Chlorobenzyl cyanide	Narcotic	View
221	2-Methyl-5-nitrophenol	Non-narcotic	View
222	1-Bromo-4-ethylbenzene	Narcotic	View
223	4-Isopropylbenzaldehyde	Narcotic	View
224	2-Nitrophenol	Non-narcotic	View
225	1-Chloro-2-nitrobenzene	Non-narcotic	View
226	4-Benzoylaniline	Narcotic	View
227	1,4-Dibromobenzene	Narcotic	View
228	4-bromophenol	Narcotic	View
229	2-Chloro-6-nitrotoluene	Non-narcotic	View
230	2-Chloro-4,5-dimethylphenol	Narcotic	View
231	Cumene	Narcotic	View
232	4-Chloro-2-methylphenol	Narcotic	View
233	4-Butoxyphenol	Narcotic	View
234	2-Hydroxy-4,5-dimethylacetophenone	Narcotic	View
235	Ethyl-4-nitrobenzoate	Narcotic	View
236	3,5-Dichloroaniline	Narcotic	View
237	2,4-Dinitroaniline	Non-narcotic	View
238	3-Nitroanisole	Narcotic	View
239	1-Chloro-3-nitrobenzene	Non-narcotic	View
240	2,6-Dichlorophenol	Narcotic	View
241	3-tert-Butylphenol	Narcotic	View
242	1-Bromo-2-nitrobenzene	Non-narcotic	View
243	2-Chloromethyl-4-nitrophenol	Non-narcotic	View
244	2-Chloro-4-nitroaniline	Non-narcotic	View
245	Isoeugenol	Narcotic	View
246	4,5-Difluoro-2-nitroaniline	Non-narcotic	View
247	1,1-Diphenyl-2-propanol	Narcotic	View
248	2,6-Diisopropylaniline	Narcotic	View
249	3-Chloro-5-methoxyphenol	Narcotic	View
250	4-Ethoxy-2-nitroaniline	Non-narcotic	View
251	1,3-Dinitrobenzene	Non-narcotic	View
252	α,α,α-4-Tetrafluoro-3-toluidine	Narcotic	View
253	Ethyl-4-methoxybenzoate	Narcotic	View
254	4-Chloro-3-methylphenol	Narcotic	View
255	(+/-)-1,2-Diphenyl-2-propanol	Narcotic	View
256	3-Chloro-4-fluoronitrobenzene	Non-narcotic	View
257	Methyl-2,5-dichlorobenzoate	Narcotic	View
258	Pentafluorobenzaldehyde	Non-narcotic	View
259	Methyl-4-chloro-2-nitrobenzoate	Non-narcotic	View
260	4-Bromophenyl-3-pyridyl ketone	Narcotic	View
261	4-Chloro-2-nitrotoluene	Non-narcotic	View
262	4-Nitrophenetole	Narcotic	View
263	2,6-Dinitrophenol	Non-narcotic	View
264	2,6-Dinitroaniline	Non-narcotic	View
265	4-Iodophenol	Narcotic	View
266	2-Nitromesitylene	Non-narcotic	View
267	1,3,5-Trichlorobenzene	Narcotic	View
268	2,4-Dinitrotoluene	Non-narcotic	View
269	6-Phenyl-1-hexanol	Narcotic	View
270	3-Chlorophenol	Narcotic	View
271	Benzophenone	Narcotic	View
272	4-(tert.)Butylphenol	Narcotic	View
273	4-Biphenylmethanol	Narcotic	View
274	3,4,5-Trimethylphenol	Narcotic	View
275	2,2’,4,4’-Tetrahydroxybenzophenone	Non-narcotic	View
276	4-Pentyloxyaniline	Narcotic	View
277	2,4-Dichloronitrobenzene	Non-narcotic	View
278	(trans)Ethyl cinnamate	Non-narcotic	View
279	4-Benzoylphenol	Narcotic	View
280	4-Benzoylphenol	Narcotic	View
281	1-Bromo-3-nitrobenzene	Non-narcotic	View
282	2,4-Dichlorobenzaldehyde	Non-narcotic	View
283	2,4-Dichlorophenol	Narcotic	View
284	2,5-Dinitrophenol	Non-narcotic	View
285	Biphenyl	Narcotic	View
286	2,4-Dinitrophenol	Non-narcotic	View
287	3,4-Dichlorotoluene	Narcotic	View
288	2,3-Dichloronitrobenzene	Non-narcotic	View
289	Benzyl-4-hydroxyphenyl ketone	Narcotic	View
290	4-Butylaniline	Narcotic	View
291	4-Chloro-3-ethylphenol	Narcotic	View
292	1,2,4-Trichlorobenzene	Narcotic	View
293	1-Fluoro-3-iodo-5-nitrobenzene	Non-narcotic	View
294	Resorcinol monobenzoate	Narcotic	View
295	4-Biphenylcarboxaldehyde	Narcotic	View
296	6-Chloro-2,4-dinitroaniline	Non-narcotic	View
297	2,5-Dichloronitrobenzene	Non-narcotic	View
298	3,5-Dichloronitrobenzene	Non-narcotic	View
299	6-tert-Butyl-2,4-dimethylphenol	Narcotic	View
300	2-Bromo-5-nitrotoluene	Non-narcotic	View
301	3,5-Dibromo-4-hydroxybenzonitrile	Non-narcotic	View
302	3,4-Dichloronitrobenzene	Non-narcotic	View
303	2,2’-Dihydroxybenzophenone	Non-narcotic	View
304	4-Bromo-2,6-dimethylphenol	Narcotic	View
305	4-Nitrobenzyl chloride	Non-narcotic	View
306	4-(pentyloxy)Benzaldehyde	Narcotic	View
307	Hexanophenone	Narcotic	View
308	4-Chloro-3,5-dimethylphenol	Narcotic	View
309	4-tert-Pentylphenol	Narcotic	View
310	n-Propyl cinnamate	Narcotic	View
311	2-Bromo-4,6-dinitroaniline	Non-narcotic	View
312	n-Butylbenzene	Narcotic	View
313	1,2-Dinitrobenzene	Non-narcotic	View
314	4-Bromobenzophenone	Narcotic	View
315	4-Phenoxybenzaldehyde	Narcotic	View
316	2,4-Dichloro-6-nitroaniline	Non-narcotic	View
317	4-Chloro-3-nitrophenol	Non-narcotic	View
318	4-Bromo-6-chloro-2-cresol	Narcotic	View
319	2,4,5-Trichloroaniline	Narcotic	View
320	1,4-Dinitrobenzene	Non-narcotic	View
321	2-Nitrobiphenyl	Narcotic	View
322	Olivetol	Narcotic	View
323	Ethyl-4-bromobenzoate	Narcotic	View
324	2’,3’,4’-Trichloroacetophenone	Narcotic	View
325	Phenyl benzoate	Narcotic	View
326	2,5-Dibromonitrobenzene	Non-narcotic	View
327	Phenyl-4-hydroxybenzoate	Narcotic	View
328	4-Hexyloxyaniline	Narcotic	View
329	2,4-Dibromophenol	Narcotic	View
330	2,4,6-Trichlorophenol	Narcotic	View
331	Phenyl isothiocyanate	Non-narcotic	View
332	2-Hydroxy-4-methoxybenzophenone	Narcotic	View
333	1,3,5-Trichloro-2-nitrobenzene	Non-narcotic	View
334	Benzyl benzoate	Narcotic	View
335	2,5-Diphenyl-1,4-benzoquinone	Non-narcotic	View
336	Isoamyl-4-hydroxybenzoate	Narcotic	View
337	4-Chlorobenzophenone	Narcotic	View
338	1,2,3-Trichloro-4-nitrobenzene	Non-narcotic	View
339	1,2,4-Trichloro-5-nitrobenzene	Non-narcotic	View
340	n-Butyl cinnamate	Non-narcotic	View
341	3,5-Dichlorosalicylaldehyde	Narcotic	View
342	3-Chlorobenzophenone	Narcotic	View
343	Heptanophenone	Narcotic	View
344	3,5-Dichlorophenol	Narcotic	View
345	4-Nitrophenyl phenyl ether	Narcotic	View
346	2,4-Dibromo-6-nitroaniline	Non-narcotic	View
347	Pentafluorophenol	Non-narcotic	View
348	4-Chloro-6-nitro-3-cresol	Non-narcotic	View
349	3,5-di-tert-Butylphenol	Narcotic	View
350	3,5-Dibromosalicylaldehyde	Narcotic	View
351	3-Trifluoromethyl-4-nitrophenol	Non-narcotic	View
352	4,5-Dichloro-2-nitroaniline	Non-narcotic	View
353	2,4-Dinitro-1-fluorobenzene	Narcotic	View
354	2-(Benzylthio)-3-nitropyridine	Non-narcotic	View
355	4,6-Dinitro-2-cresol	Non-narcotic	View
356	2,4-Chloro-6-nitrophenol	Non-narcotic	View
357	2,3,5,6-Tetrachloroaniline	Non-narcotic	View
358	4-Bromo-2,6-dichlorophenol	Narcotic	View
359	2,3,4,5-Tetrachloronitrobenzene	Non-narcotic	View
360	n-Amylbenzene	Narcotic	View
361	4-Hexylresorcinol	Narcotic	View
362	4-(tert.)Butyl-2,6-dinitrophenol	Non-narcotic	View
363	2,6-Iodo-4-nitrophenol	Non-narcotic	View
364	2,3,5,6-Tetrachloronitrobenzene	Non-narcotic	View
365	2,3,4,6-Tetrafluoronitrobenzene	Non-narcotic	View
366	Octanophenone	Narcotic	View
367	1,2,3-Trifluoro-4-nitrobenzene	Non-narcotic	View
368	2,4,6-Bromophenol	Narcotic	View
369	2,3,4,5-Tetrachloroaniline	Non-narcotic	View
370	4-Ethylbiphenyl	Narcotic	View
371	1,2,4,5-Tetrachlorobenzene	Narcotic	View
372	Pentachlorophenol	Non-narcotic	View
373	2,4,5-Trichlorophenol	Narcotic	View
374	2,4-Dinitro-1-iodobenzene	Non-narcotic	View
375	1-Chloro-2,4-dinitrobenzene	Non-narcotic	View
376	2,3,4,6-Tetrachlorophenol	Non-narcotic	View
377	1,3,5-Trichloro-2,4-dinitrobenzene hemihydrate	Non-narcotic	View
378	1,2-Dichloro-4,5-dinitrobenzene	Non-narcotic	View
379	1,5-Dichloro-2,3-dinitrobenzene	Non-narcotic	View
380	Nonylphenol	Narcotic	View
381	3,4,5,6-Tetrabromo-2-cresol	Non-narcotic	View
382	1,3-Dinitro-2,4,5-trichlorobenzene	Non-narcotic	View
383	Pentabromophenol	Non-narcotic	View
384	2,3,4,5-Tetrachlorophenol	Non-narcotic	View
385	1,4-Dinitrotetrachlorobenzene	Non-narcotic	View
386	3-Hydroxybenzyl alcohol	Narcotic	View
387	4-Hydroxy-3-methoxybenzylamine HCl	Narcotic	View
388	4-Aminobenzamide	Narcotic	View
389	Benzamide	Narcotic	View
390	2-(2-Hydroxyethyl)resorcinol	Narcotic	View
391	4-Acetamidophenol	Non-narcotic	View
392	4-Hydroxybenzamide	Narcotic	View
393	Orcinol monohydrate	Non-narcotic	View
394	1,2-Dicyanobenzene	Non-narcotic	View
395	5-Chloro-2-nitrobenzamide	Non-narcotic	View
396	Phenyl acetate	Narcotic	View
397	4-Acetamidobenzaldehyde	Non-narcotic	View
398	Methyl phenoxyacetate	Narcotic	View
399	3-Nitrobenzamide	Non-narcotic	View
400	2-Nitrobenzyl alcohol	Narcotic	View
401	Methyl-3,5-dihydroxybenzoate	Narcotic	View
402	5-Acetylsalicylamide	Narcotic	View
403	3-Cyanophenol	Narcotic	View
404	Methyl-4-cyanobenzoate	Non-narcotic	View
405	3-Methoxybenzonitrile	Narcotic	View
406	3-Phenyl-1-butanol	Narcotic	View
407	2-Cyanophenol	Narcotic	View
408	4-Cyanobenzaldehyde	Non-narcotic	View
409	3-Hydroxybenzaldehyde	Narcotic	View
410	4-Chlorobenzamide	Narcotic	View
411	N,N-Dimethylbenzylamine	Narcotic	View
412	2-Chloro-5-methylaniline	Narcotic	View
413	1-Fluoro-3-nitrobenzene	Non-narcotic	View
414	3-Anisaldehyde	Narcotic	View
415	Salicylaldoxime	Non-narcotic	View
416	3,4-Dinitrophenol	Non-narcotic	View
417	N-Ethyl-N-methylaniline	Narcotic	View
418	Methyl-4-formylbenzoate	Narcotic	View
419	2-Iodobenzyl alcohol	Narcotic	View
420	4-Methyl-2-nitroaniline	Non-narcotic	View
421	Ethyl-4-cyanobenzoate	Narcotic	View
422	1-Bromo-4-nitrobenzene	Non-narcotic	View
423	2,3-Dinitrophenol	Non-narcotic	View
424	2-Methyl-4-nitroaniline	Non-narcotic	View
425	2-Chlorobenzaldehyde	Narcotic	View
426	4-Amino-3,5-dinitrobenzamide	Non-narcotic	View
427	3,5-Dinitrobenzyl alcohol	Non-narcotic	View
428	4-Nitroanisole	Narcotic	View
429	4-Nitrobenzonitrile	Non-narcotic	View
430	Methyl-4-ethoxybenzoate	Narcotic	View
431	2-Chloro-5-nitroaniline	Non-narcotic	View
432	2-Chloro-5-nitroaniline	Non-narcotic	View
433	2,6-Dichloro-4-nitrophenol	Non-narcotic	View
434	N,N-Diethylaniline	Narcotic	View
435	3-Benzylpyridine	Narcotic	View
436	2,6-Dichloro-3-methylaniline	Narcotic	View
437	4-Methyl-3-nitrophenol	Narcotic	View
438	6-Chloro-2-fluoro-3-methylbenzaldehyde	Narcotic	View
439	2-Methyl-3-nitrophenol	Narcotic	View
440	1,2,4-Trimethylbenzene	Narcotic	View
441	4-Chloro-3-nitrobenzotrifluoride	Non-narcotic	View
442	2-Bromo-2’-hydroxy-5’-nitroacetanilide	Narcotic	View
443	2,6-Dibromoaniline	Narcotic	View
444	3-Fluoro-4-nitrophenol	Non-narcotic	View
445	3,5-Dinitroaniline	Non-narcotic	View
446	3,5-Dinitroaniline	Non-narcotic	View
447	4-Bromo-2-fluoro-6-nitroanisole	Non-narcotic	View
448	2,5-Dinitrophenol	Non-narcotic	View
449	5-Fluoro-2-nitrophenol	Non-narcotic	View
450	4-Chloro-2,6-dinitroaniline	Non-narcotic	View
451	2-Chloro-4-nitrophenol	Non-narcotic	View
452	4-Chloro-3-nitrobenzaldehyde	Non-narcotic	View
453	2-Amino-6-chloro-4-nitrophenol	Non-narcotic	View
454	3,5-Dinitrobenzonitrile	Non-narcotic	View
455	2,6-Dinitro-4-cresol	Non-narcotic	View
456	3-Chloro-2-fluoro-5-(trifluoromethyl)benzaldehyde	Narcotic	View
457	2,6-Bromo-4-nitrophenol	Non-narcotic	View
458	n-Amylbenzoate	Narcotic	View
459	3,5-di(tert.)Butylaniline	Narcotic	View
460	4-Chloro-2,6-dibromoaniline	Narcotic	View
461	3,4-Dinitrotoluene	Non-narcotic	View
462	Ethyl-4-iodobenzoate	Narcotic	View
463	1,2,3-Trichloro-5-nitrobenzene	Non-narcotic	View
464	4-Cyclohexylphenol	Narcotic	View
465	3-Nitrobiphenyl	Narcotic	View
466	Vinyl 4-tert.butyl benzoate	Narcotic	View
467	4-Bromo-2-fluoro-6-nitrophenol	Non-narcotic	View
468	4-Bromo-2-fluoro-6-nitrophenol	Non-narcotic	View
469	4-Phenyltoluene	Narcotic	View
470	2,4-Dinitro-5-fluoroaniline	Non-narcotic	View
471	4-Chloro-3-nitrobenzonitrile	Non-narcotic	View
472	2,3,5-Trichlorobenzaldehyde	Narcotic	View
473	2,6-di(tert)Butyl-4-methylphenol	Narcotic	View
474	4-Chloro-2-nitrophenol	Non-narcotic	View
475	2,4-Dibromo-6-phenylphenol	Narcotic	View
476	5-Chloro-2,4-dinitrotoluene	Non-narcotic	View
477	3,5-Diiododalicyaldehyde	Non-narcotic	View
478	Nonyl-4-hydroxybenzoate	Narcotic	View
479	1,3-Dichloro-4,6-dinitrobenzene	Non-narcotic	View
480	Phenoxyacetamide	Narcotic	View
481	1-Phenylbiguanide	Non-narcotic	View
482	Phenyl carbamate	Non-narcotic	View
483	γ-Phenyl-γ-butyrolactone	Narcotic	View
484	Benzohydroxamic acid	Non-narcotic	View
485	1-Benzoylacetone	Non-narcotic	View
486	1-Phenyl-2-thiourea	Non-narcotic	View
487	4-Phenyl-1-butylamine	Narcotic	View
488	4-Nitrosophenol	Non-narcotic	View
489	trans-Cinnamaldehyde	Non-narcotic	View
490	Diethyl benzylmalonate	Non-narcotic	View
491	Benzyl thiocyanate	Non-narcotic	View
492	Benzyl acrylate	Non-narcotic	View
493	trans Chalcone	Non-narcotic	View
494	Ethyl phenylpropiolate	Non-narcotic	View
495	α-Chlorocinnamaldehyde	Non-narcotic	View
496	4-Nitrophenyl bromoacetate	Non-narcotic	View
497	Phenylpropargyl aldehyde	Non-narcotic	View
498	4-Chloro-3-nitrophenyl isothiocyanate	Non-narcotic	View
499	1-Bromomethyl-4-nitrobenzene	Non-narcotic	View
500	1,4-Dicyano-tetrafluorobenzene	Non-narcotic	View
501	Benzyl isothiocyanate	Non-narcotic	View

10967/84 - QDB Compounds

QsarDB Repository

Schultz, T.W.; Hewitt, M.; Netzeva, T.I.; Cronin, M.T.D. Assessing Applicability Domains of Toxicological QSARs: Definition, Confidence in Predicted Values, and the Role of Mechanisms of Action. QSAR Comb. Sci. 2007, 26, 2, 238–254.

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