Benigni, R.; Bossa, C.; Netzeva, T. I.; Rodomonte, A.; Tsakovska, I. Mechanistic QSAR of aromatic amines: New models for discriminating between homocyclic mutagens and nonmutagens, and validation of models for carcinogens. Environ. Mol. Mutagen. 2007, 48, 754–771.

111 compounds

ID	Name	Details
1	1-Aminofluoranthene	View
2	1-Amino-2-methylnaphthalene	View
3	1-Aminoanthracene	View
4	1-Aminonaphthalene	View
5	1-Aminocarbazole	View
6	1-Aminofluorene	View
7	1-Aminophenanthrene	View
8	1-Aminopyrene	View
9	2,2'-Diaminobiphenyl	View
10	2,4,5-Trimethylaniline	View
11	2,4-Diaminoisopropylbenzene	View
12	2,4-Difluoroaniline	View
13	2,4-Dimethylaniline i	View
14	2,4'-Diaminobiphenyl	View
15	2,6-Dichloro-1,4-phenylenediamine	View
16	2-Amino-1-methylnaphthalene	View
17	2-Amino-3-methylnaphthalene	View
18	2-Amino-4-chlorophenol	View
19	2-Amino-4-methylphenol	View
20	2-Aminoanthracene	View
21	2-Aminobiphenyl	View
22	2-Aminocarbazole	View
23	2-Aminofluoranthene	View
24	2-Aminofluorene	View
25	2-Aminonaphthalene	View
26	2-Aminophenanthrene	View
27	2-Aminopyrene	View
28	2-Ethyl-4-chloroaniline	View
29	2-Methyl-4-bromoaniline	View
30	2-Methyl-4-chloroaniline	View
31	3,3'-Diaminobiphenyl	View
32	3,3'-Dichlorobenzidine	View
33	3,3'-Dimethoxybenzidine	View
34	3,4'-Diaminobiphenyl	View
35	3-Amino-4-methylbiphenyl	View
36	3-Trifluoromethylaniline	View
37	3-Aminocarbazole i	View
38	3-Aminofluoranthene	View
39	3-Aminofluorene	View
40	3-Aminophenanthrene	View
41	3-Aminoquinoline	View
42	4,4'-Ethylenebis(aniline)	View
43	4,4'-Methylenebis(o-ethylaniline)	View
44	4,4'-Methylenebis(o-fluoroaniline)	View
45	4,4'-Methylenebis(o-isopropyl-aniline)	View
46	4,4'-Methylenedianiline i	View
47	4-Aminophenyldisulfide	View
48	4-Amino-3-methylbiphenyl	View
49	4-Aminobiphenyl	View
50	4-Aminocarbazole	View
51	4-Aminofluorene	View
52	4-Aminophenanthrene	View
53	4-Aminophenylether	View
54	4-Aminophenylsulfide	View
55	4-Aminopyrene	View
56	4-Bromoaniline	View
57	4-Chloro-1,2-phenylenediamine	View
58	4-Cyclohexylaniline	View
59	4-Ethoxyaniline i	View
60	4-Methoxy-2-methylaniline i	View
61	2-Chloro-4-methylaniline	View
62	4-Methyl-2-chloroaniline	View
63	4-Phenoxyaniline	View
64	5-Aminoquinoline	View
65	6-Aminochrysene	View
66	6-Aminoquinoline	View
67	7-Aminofluoranthene	View
68	8-Aminofluoranthene	View
69	8-Aminoquinoline	View
70	9-Aminoanthracene	View
71	9-Aminophenanthrene	View
72	Benzidine	View
73	4-Methoxyaniline i	View
74	3-Methoxyaniline	View
75	Aniline i	View
76	3-Chloroaniline	View
77	3-Ethoxyaniline	View
78	2-Ethoxyaniline	View
79	4-Aminophenol	View
80	3-Aminophenol	View
81	4,4'-Methylenebis(2,6-diisopropylaniline)	View
82	4,4'-Methylenebis(2,6-diethylaniline)	View
83	4,4'-Methylenebis(2-methyl-6-t-butylaniline)	View
84	4,4'-Methylenebis(2-methyl-6-isopropylaniline)	View
85	4,4'-Methylenebis(2-methyl-6-ethylaniline)	View
86	4,4'-Methylenebis(2,6-dimethylaniline)	View
87	3-Aminobiphenyl	View
88	2,3'-Diaminobiphenyl i	View
89	2-Methoxyaniline i	View
90	2-Aminophenol	View
91	2,4,6-Trimethylaniline i	View
92	2,4,6-Tribromoaniline	View
93	2,4,6-Trichloroaniline	View
94	2,6-Diethylaniline	View
95	3,5-Dimethylaniline	View
96	2,6-Dimethylaniline	View
97	2,4-Dibromoaniline	View
98	2,4-Dichloroaniline	View
99	4-Iodoaniline	View
100	2-Iodoaniline	View
101	2-Fluoroaniline	View
102	2-Bromoaniline	View
103	4-Ethylaniline	View
104	2-Ethylaniline	View
105	4-Methylaniline i	View
106	3-Methylaniline i	View
107	2-Methylaniline i	View
108	4'-nButyl-4-aminobiphenyl	View
109	4'-tButyl-4-aminobiphenyl	View
110	4'-Trifluoromethyl-4-aminobiphenyl	View
111	3'-Trifluoromethyl-4-aminobiphenyl	View

10967/141 - QDB Compounds

QsarDB Repository

Benigni, R.; Bossa, C.; Netzeva, T. I.; Rodomonte, A.; Tsakovska, I. Mechanistic QSAR of aromatic amines: New models for discriminating between homocyclic mutagens and nonmutagens, and validation of models for carcinogens. Environ. Mol. Mutagen. 2007, 48, 754–771.

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