Schultz, T.W. Structure-Toxicity Relationships for Benzenes Evaluated with Tetrahymena pyriformis. Chem. Res. Toxicol. 1999, 12, 12, 1262–1267.

220 compounds | Property pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]

ID	Name	pIGC50	Details
1	benzyl alcohol	-0.83	View
2	benzylamine	-0.24	View
3	sec-phenethyl alcohol	-0.66	View
4	3-phenyl-1-propanol	-0.21	View
5	1-phenyl-2-butanol	-0.16	View
6	methoxybenzene	-0.10	View
7	3-phenyl-1-butanol	0.01	View
8	benzene	-0.12	View
9	4-ethylbenzyl alcohol	0.07	View
10	(+/-)-2-phenyl-2-butanol	0.06	View
11	4-phenyl-1-butanol	0.12	View
12	α,α-dimethylbenzenepropanol	-0.07	View
13	1-phenyl-1-butanol	-0.01	View
14	ethoxybenzene	0.10	View
15	methylbenzene	0.25	View
16	thioanisole	0.18	View
17	5-phenyl-1-pentanol	0.42	View
18	4-methylanisole	0.25	View
19	1,1-diphenyl-2-propanol	0.75	View
20	4-biphenylmethanol	0.92	View
21	1,4-dimethylbenzene	0.25	View
22	benzophenone	0.87	View
23	(+/-)-1,2-diphenyl-2-propanol	0.80	View
24	6-phenyl-1-hexanol	0.87	View
25	isopropylbenzene	0.69	View
26	biphenyl	1.05	View
27	n-butylbenzene	1.25	View
28	n-amylbenzene	1.79	View
29	4-ethylbiphenyl	1.97	View
30	aniline	-0.23	View
31	4-methylaniline	-0.05	View
32	3-methylaniline	-0.28	View
33	2-methylaniline	-0.16	View
34	2-ethylaniline	-0.22	View
35	2-phenyl-3-butyn-2-ol	-0.18	View
36	3-ethylaniline	-0.03	View
37	4-ethylaniline	0.03	View
38	4-butoxyaniline	0.61	View
39	2,6-diethylaniline	0.31	View
40	4-pentyloxyaniline	0.97	View
41	2,6-diisopropylaniline	0.76	View
42	4-butylaniline	1.07	View
43	4-methoxyphenol	-0.14	View
44	benzaldehyde	-0.20	View
45	phenol	-0.35	View
46	3-methoxyphenol	-0.33	View
47	3-ethoxy-4-hydroxybenzaldehyde	0.02	View
48	acetophenone	-0.05	View
49	4-methylphenol	-0.16	View
50	2-methylphenol	-0.29	View
51	3-methylphenol	-0.08	View
52	propiophenone	0.05	View
53	2,4-dimethylphenol	0.14	View
54	2-ethylphenol	0.16	View
55	4-ethylphenol	0.21	View
56	3-ethylphenol	0.29	View
57	2-allylphenol	0.33	View
58	2,3,6-trimethylphenol	0.28	View
59	2,4,6-trimethylphenol	0.42	View
60	butyrophenone	0.30	View
61	3,4,5-trimethylphenol	0.93	View
62	2,3,5-trimethylphenol	0.36	View
63	4-isopropylbenzaldehyde	0.67	View
64	valerophenone	0.56	View
65	4-propylphenol	0.64	View
66	iodobenzene	0.50	View
67	4-tert-butylphenol	0.91	View
68	4-hexyloxyaniline	1.38	View
69	4-tert-pentylphenol	1.23	View
70	4-pentyloxybenzaldehyde	1.18	View
71	heptanophenone	1.56	View
72	octanophenone	1.89	View
73	nonylphenol	2.47	View
74	1,3-dihydroxybenzene	-0.65	View
75	thiobenzamide	0.09	View
76	4-chlorobenzamide	0.16	View
77	4-chloroaniline	0.05	View
78	2-chloroaniline	-0.17	View
79	3-chloroaniline	0.22	View
80	2-tolunitrile	-0.24	View
81	benzyl chloride	0.10	View
82	2-chloro-4-methylaniline	0.18	View
83	4-chloroanisole	0.60	View
84	olivetol	1.31	View
85	4-hexylresorcinol	1.80	View
86	salicylaldehyde	0.42	View
87	2-hydroxy-4-methoxy-acetophenone	0.55	View
88	4-chlorophenol	0.54	View
89	chlorobenzene	-0.13	View
90	phenethyl bromide	0.50	View
91	4-chloro-3-methylphenol	0.80	View
92	4-chlorobenzophenone	1.50	View
93	2-amino-5-chlorobenzonitrile	0.44	View
94	5-bromovanillin	0.62	View
95	3-chlorophenol	0.87	View
96	3-chloro-5-methoxyphenol	0.76	View
97	3,4-dichloroaniline	0.56	View
98	2,5-dichloroaniline	0.58	View
99	3,5-dichloroaniine	0.71	View
100	bromobenzene	0.75	View
101	2,4-dichlorophenol	1.04	View
102	4-chloro-3,5-dimethylphenol	1.20	View
103	4-bromotoluene	1.00	View
104	3,4-dichlorotoluene	1.07	View
105	1-bromo-4-ethylbenzene	1.10	View
106	3-nitroaniline	0.03	View
107	nitrobenzene	0.14	View
108	3-nitroanisole	0.72	View
109	2-nitrotoluene	0.26	View
110	4-nitrotoluene	0.65	View
111	4-ethoxy-2-nitroaniline	0.76	View
112	3-nitrotoluene	0.42	View
113	α,α,α-4-tetrafluoro-m-toluidine	0.77	View
114	4-nitrophenetole	0.83	View
115	1,2-dimethyl-3-nitrobenzene	0.56	View
116	1,2-dimethyl-4-nitrobenzene	0.59	View
117	1,2-dichlorobenzene	1.00	View
118	3,5-dichlorophenol	1.56	View
119	2,4,5-trichloroaniline	1.30	View
120	1,4-dibromobenzene	0.68	View
121	5-hydroxy-2-nitrobenzaldehyde	0.33	View
122	2-nitrophenol	0.67	View
123	2-nitroaniline	0.08	View
124	2-chloro-4-nitroaniline	0.75	View
125	4-chlorobenzaldehyde	0.40	View
126	pentafluorobenzaldehyde	0.82	View
127	2,4,6-trichlorophenol	1.41	View
128	2,4,5-trichlorophenol	2.10	View
129	1,2,4-trichlorobenzene	1.10	View
130	2,4,6-tribromophenol	1.91	View
131	1,3,5-trichlorobenzene	0.87	View
132	pentafluoroaniline	0.26	View
133	1-fluoro-4-nitrobenzene	0.10	View
134	1-chloro-3-nitrobenzene	0.73	View
135	4-chloro-2-nitrotoluene	0.82	View
136	2-chloro-6-nitrotoluene	0.68	View
137	2,3,5,6-tetrachloroaniline	1.76	View
138	2,3,4,5-tetrachloroaniline	1.96	View
139	1,2,4,5-tetrachlorobenzene	2.00	View
140	4,5-dichloro-2-nitroaniline	1.66	View
141	phenyl isothiocyanate	1.41	View
142	2,4-dichloro-6-nitroaniline	1.26	View
143	3,5-dibromosalicylaldehyde	1.65	View
144	2,3,4,6-tetrachlorophenol	2.18	View
145	2,3,4,5-tetrachlorophenol	2.72	View
146	pentachloronitrobenzene	NTAS	View
147	pentachlorobenzene	NTAS	View
148	pentachloroanisole	NTAS	View
149	2-chloro-5-nitrobenzaldehyde	0.53	View
150	1-chloro-4-nitrobenzene	0.43	View
151	4-chloro-3-nitrophenol	1.27	View
152	1-bromo-2-nitrobenzene	0.75	View
153	1-chloro-2-nitrobenzene	0.68	View
154	1-bromo-3-nitrobenzene	1.03	View
155	3-(trifluoromethyl)-4-nitrophenol	1.65	View
156	1-fluoro-3-iodo-5-nitrobenzene	1.09	View
157	2-bromo-1-methyl-5-nitrobenzene	1.16	View
158	3,4,5,6-tetrabromo-2-methylphenol	2.57	View
159	pentachlorophenol	2.07	View
160	3-nitrobenzonitrile	0.45	View
161	1,3-dinitrobenzene	0.76	View
162	1,2-dinitrobenzene	1.25	View
163	1-methyl-2,4-dinitrobenzene	0.87	View
164	2,5-dichloro-1-nitrobenzene	1.13	View
165	2,3-dichloro-1-nitrobenzene	1.07	View
166	2,4-dichloro-1-nitrobenzene	0.99	View
167	3,5-dichloro-1-nitrobenzene	1.13	View
168	3,4-dichloro-1-nitrobenzene	1.16	View
169	pentabromophenol	2.66	View
170	2,4-dinitroaniline	0.72	View
171	2,6-dinitroaniline	0.84	View
172	3-chloro-4-fluoro-1-nitrobenzene	0.80	View
173	3,4-dinitrobenzyl alcohol	1.09	View
174	1,4-dinitrobenzene	1.30	View
175	6-chloro-2,4-dinitroaniline	1.12	View
176	2-bromo-4,6-dinitroaniline	1.24	View
177	1,2,4-trichloro-5-nitrobenzene	1.53	View
178	1,2,3-trichloro-4-nitrobenzene	1.51	View
179	1,3,5-trichloro-2-nitrobenzene	1.43	View
180	2,6-dinitrophenol	0.83	View
181	2,4-dinitrophenol	1.06	View
182	2,5-dinitrophenol	1.04	View
183	4,6-dinitro-2-methylphenol	1.73	View
184	4-tert-butyl-2,6-dinitrophenol	1.80	View
185	1,2,3-trifluoro-4-nitrobenzene	1.89	View
186	2,3,4,5-tetrachloronitrobenzene	1.78	View
187	2,3,5,6-tetrachloronitrobenzene	1.82	View
188	1,5-difluoro-2,4-dinitrobenzene	2.08	View
189	2,3,4,6-tetrafluoronitrobenzene	1.87	View
190	1-iodo-2,4-dinitrobenzene	2.12	View
191	1-fluoro-2,4-dinitrobenzene	1.71	View
192	pentafluoronitrobenzene	2.43	View
193	1-bromo-2,4-dinitrobenzene	2.31	View
194	1,2-dichloro-4,5-dinitrobenzene	2.21	View
195	1,5-dichloro-2,3-dinitrobenzene	2.42	View
196	1-chloro-2,4-dinitrobenzene	2.16	View
197	1,3,5-trichloro-2,4-dinitrobenzene	2.19	View
198	1,3-dinitro-2,4,5-trichlorobenzene	2.60	View
199	4-chloro-3,5-dinitrobenzonitrile	2.66	View
200	1,4-dinitrotetrachlorobenzene	2.82	View
201	4-ethylbenzyl alcohol	0.07	View
202	3-aminobenzyl alcohol	-1.13	View
203	3,4-dimethylaniline	-0.16	View
204	4-isopropylaniline	0.22	View
205	4-hydroxyphenethyl alcohol	-0.83	View
206	4-hydroxypropiophenone	0.05	View
207	4-tert-pentylphenol	1.23	View
208	2-(4-chlorophenyl)ethylamine	0.14	View
209	vanillin	-0.03	View
210	4-iodophenol	0.85	View
211	4-bromobenzophenone	1.26	View
212	4-methyl-2-nitroaniline	0.37	View
213	4-bromo-6-chloro-2-methylphenol	1.28	View
214	2,4-dibromophenol	1.40	View
215	4-bromo-2,6-dichlorophenol	1.78	View
216	pentafluorophenol	1.63	View
217	4-nitrobenzyl chloride	1.18	View
218	4-chloro-6-nitro-3-methylphenol	1.63	View
219	2,6-diiodo-4-nitrophenol	1.81	View
220	2,4-dichloro-6-nitrophenol	1.75	View

Bibliography

Schultz, T. W. Structure-Toxicity Relationships for Benzenes Evaluated with Tetrahymena pyriformis. Chem. Res. Toxicol. 1999, 12, 1262–1267. https://doi.org/10.1021/tx9900730
Schultz, T. W. TETRATOX: Tetrahymena pyriformis population growth impairment endpoint - a surrogate for fish lethality. Toxicol. Mech. Meth. 1997, 7, 289–309. https://doi.org/10.1080/105172397243079

10967/19 - QDB Compounds

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Schultz, T.W. Structure-Toxicity Relationships for Benzenes Evaluated with Tetrahymena pyriformis. Chem. Res. Toxicol. 1999, 12, 12, 1262–1267.

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