Ren, S.; Frymier, P.D.; Schultz, T.W. An exploratory study of the use of multivariate techniques to determine mechanisms of toxic action. Ecotoxicol. Environ. Saf. 2003, 55, 1, 86–97.

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

ID	Name	pIGC50	Details
1	Ethylcarbamate	-1.65	View
2	Benzamide	-0.91	View
3	Ethanol	-2.31	View
4	Methanol	-2.72	View
5	2-Propanol	-1.88	View
6	Acetone	-2.15	View
7	Dimethylsulfoxide	-2.49	View
8	1-Propanol	-1.75	View
9	1-Butanol	-1.43	View
10	1-Pentanol	-1.07	View
11	Acetonitrile	-2.28	View
12	2-Methyl-2-propanol	-1.79	View
13	2-Methyl-1-propanol	-1.37	View
14	2-Butanone	-1.75	View
15	Naphthalene	-0.12	View
16	Quinoline	0.09	View
17	N,N-Diethylaniline	0.67	View
18	Biphenyl	1.05	View
19	Benzothiazole	-0.03	View
20	1,2-Dichlorobenzene	0.53	View
21	3,4-Dichlorotoluene	1.22	View
22	3-Pentanone	-1.46	View
23	Isopropylbenzene	0.69	View
24	Acetophenone	-0.46	View
25	A,A-Dimethylbenzene propanol	-0.07	View
26	N,N-Dimethylbenzylamine	0.12	View
27	N-Butylbenzene	1.25	View
28	2-Ethyl-1-hexanol	0.17	View
29	5-Ethyl-2-methylpyridine	-0.18	View
30	Propionitrile	-1.97	View
31	2-Pentanone	-1.44	View
32	4-Methyl-2-pentanone	-1.21	View
33	Bromobenzene	0.08	View
34	4-Methylpyridine	-0.88	View
35	Cyclohexanol	-0.77	View
36	3-Methylpyridine	-0.99	View
37	2-Methylpyridine	-1.01	View
38	Pyrrole	-1.09	View
39	5-Methyl-2-hexanone	-0.65	View
40	2-Heptanone	-0.49	View
41	6-Methyl-5-hepten-2-one	-0.45	View
42	2-Octanone	-0.15	View
43	1-Hexanol	-0.38	View
44	1-Heptanol	0.10	View
45	1-Octanol	0.58	View
46	2-Undecanone	1.50	View
47	Decylalcohol	1.34	View
48	1-Tridecanol	2.37	View
49	Benzophenone	0.87	View
50	1,2,4-Trichlorobenzene	1.08	View
51	N,N-Dimethylaniline	0.28	View
52	Dibenzofuran	1.42	View
53	1-Nonanol	0.86	View
54	5-Nonanone	0.07	View
55	2-Tolunitrile	-0.24	View
56	N-Amylbenzene	1.79	View
57	3-Methyl-2-butanone	-1.17	View
58	2-Hexanone	-1.34	View
59	2-Tridecanone	2.12	View
60	2-Decanone	0.58	View
61	2-Nonanone	0.66	View
62	Cis-3-Hexen-1-ol	-0.81	View
63	4-Phenylpyridine	0.66	View
64	Octylcyanide	0.62	View
65	Undecylcyanide	1.90	View
66	5-Chloro-2-pyridinol	-0.75	View
67	1-Hexen-3-ol	-0.81	View
68	1,2-bis-(4-Pyridyl)-ethane	-0.03	View
69	2-Dimethylaminopyridine	-0.55	View
70	2-Dodecanone	1.67	View
71	4-Bromophenyl-3-pyridylketone	0.82	View
72	4-Benzoylpyridine	-0.09	View
73	6-Chloro-2-picoline	-0.48	View
74	Acrylamide	-0.79	View
75	Nitrobenzene	0.14	View
76	3-Nitrotoluene	0.42	View
77	Dibutylfumarate	1.49	View
78	2-Methyl-3-butyn-2-ol	-1.49	View
79	Acetoneoxime	-1.25	View
80	2-Phenyl-3-butyn-2-ol	-0.18	View
81	4-Pentyn-2-ol	-1.63	View
82	3-Bromothiophene	-0.04	View
83	1,4-Dicyanobutane	-1.54	View
84	3-Methyl-1-pentyn-3-ol	-1.32	View
85	Cyclohexanoneoxime	-0.80	View
86	N,N-Diethylacetamide	-1.54	View
87	Anthranilamide(2-aminobenzamide)	-0.87	View
88	2-Acetyl-1-methylpyrrole	-0.69	View
89	2',3',4'-Trichloroacetophenone	1.34	View
90	2',4'-Dichloroacetophenone	0.62	View
91	4-Nitrophenylphenylether	1.58	View
92	Triphenylphosphineoxide	0.77	View
93	Triphenylphosphate	1.81	View
94	Carbontetrachloride	-0.02	View
95	Chloroacetonitrile	0.85	View
96	Malononitrile	0.22	View
97	1,2,4-Trichlorobenzene	1.08	View
98	Trans-3-Hexen-1-ol	-0.78	View
99	N-Propylsulfide	0.00	View
100	Toluene	-0.50	View
101	4-Xylene	0.12	View
102	Butylsulfide	1.04	View
103	1-Benzoylacetone	0.57	View
104	Acetaldoxime	-0.89	View
105	2-Butanoneoxime	-1.07	View
106	γ-Decanolactone	0.49	View
107	1-Bromohexane	0.94	View
108	5-Methyl-2-hexanone	-0.65	View
109	1-Bromoheptane	1.49	View
110	2,3-Benzofuran	-0.11	View
111	1-Bromooctane	1.87	View
112	2-Methylimidazole	-0.91	View
113	2,4,5-Tribromoimidazole	1.43	View
114	1-Methylpiperazine	-0.96	View
115	2,4,5-Trimethyloxazole	-1.01	View
116	Cyclohexanone	-1.23	View
117	3,3-Dimethyl-2-butanone	-1.44	View
118	2-Methyl-2,4-pentanediol	-1.96	View
119	1-(2-Aminioethyl)piperazine	-0.79	View
120	Methyl-4-chlorobenzoate	0.42	View
121	1,6-Dicyanohexane	-0.77	View
122	3-Methylindole	0.37	View
123	Flavone	1.41	View
124	2-Ethylpyridine	-0.87	View
125	2,4-Dimethyl-3-pentanol	-0.71	View
126	3-(3-Pyridyl)-1-propanol	-0.84	View
127	4-Chloro-3-methylphenol	0.80	View
128	Aniline	0.11	View
129	2-Hydroxybenzamide	-0.24	View
130	Dicumarol	1.70	View
131	4-tert-Pentylphenol	1.23	View
132	2,4,6-Trichlorophenol	1.41	View
133	2-Hydroxybenzaldehyde	0.42	View
134	1-Naphthol	0.75	View
135	2-Phenylphenol	1.09	View
136	3,5-Dibromosalicylaldehyde	1.65	View
137	Salicylaldoxime	0.25	View
138	2,4-Dihydroxybenzaldehyde	0.73	View
139	2-Methylphenol	-0.29	View
140	2-Chloroaniline	-0.25	View
141	2-Chlorophenol	0.18	View
142	4-tert-Butylphenol	0.91	View
143	Benzylamine	-0.24	View
144	N-Methylaniline	0.06	View
145	2-Cyanopyridine	-0.83	View
146	4-Acetamidophenol	-0.82	View
147	4-Butylaniline	1.07	View
148	Nonylphenol	2.47	View
149	2,4-Dimethylphenol	0.14	View
150	4-Methylphenol	-0.16	View
151	4-Chlorophenol	0.54	View
152	4-Methylaniline	-0.05	View
153	Resorcinol	-0.65	View
154	Phenol	-0.32	View
155	Pyridine	-1.32	View
156	2,4-Dichlorophenol	1.04	View
157	3-Ethoxy-4-hydroxybenaldehyde	0.02	View
158	3-Methoxy-4-hydroxybenaldehyde	-0.03	View
159	4-Ethylphenol	0.21	View
160	2,6-Di(tert)butyl-4-methylphenol	1.79	View
161	Phenyl-4-aminosalicylate	1.41	View
162	3-Methoxysalicylaldehyde	0.38	View
163	3-Methoxyphenol	-0.33	View
164	4-Methoxyphenol	-0.14	View
165	α,α,α,4-Tetrafluoro-o-toluidine	-0.02	View
166	2,4,6-Trimethylphenol	0.42	View
167	4-Ethylaniline	0.03	View
168	4-Ethoxy-2-nitroaniline	0.76	View
169	3-Acetamidophenol	-0.16	View
170	4-Propylphenol	0.64	View
171	3-Cyano-4,6-dimethyl-2-hydroxypyridine	-0.70	View
172	4-Phenoxyphenol	1.36	View
173	2-Amino-5-bromopyridine	0.49	View
174	4-Acetylpyridine	-0.87	View
175	Methyl-4-cyanobenzoate	-0.05	View
176	3-Benzyloxyaniline	0.88	View
177	2-Allylphenol	0.33	View
178	Methyl-2,4-dihydroxybenzoate	0.61	View
179	α,α,α-Tetrafluoro-m-toluidine	0.77	View
180	2,3,6-Trimethylphenol	0.28	View
181	5-Bromovanillin	0.62	View
182	N-Ethylbenzylamine	0.22	View
183	4-Octylaniline	2.43	View
184	6-Chloro-2-pyridinol	-0.29	View
185	2,6-Diisopropylaniline	0.78	View
186	4-Hexyloxyaniline	1.38	View
187	Ethyl-4-aminobenzoate	0.70	View
188	Carbazole	0.91	View
189	2-Bromo-3-pyridinol	0.15	View
190	2-Chloro-3-pyridinol	-0.01	View
191	2-Amino-4-chloro-6-methylpyrimidine	-0.47	View
192	5-Bromosalicylaldehyde	1.11	View
193	5-Chlorosalicylaldehyde	1.01	View
194	2,4-Diaminotoulene	-0.66	View
195	3'-Aminoacetophenone	-0.82	View
196	1,4-bis(3-Aminopropyl)piperazine	-0.66	View
197	2,2'-Methylenebis(3,4,6-trichlorophenol)	3.04	View
198	2,3,4-Trichloroaniline	1.35	View
199	2-Chloro-4-methylaniline	0.18	View
200	3-Cyano-4,6-dimethyl-2-hydrox	-0.70	View
201	Phenyl-4-aminosalicylate	1.41	View
202	3-Benzyloxyaniline	0.88	View
203	2,4,6-Triiodophenol	2.67	View
204	4,6-Dimethyl-2-hydroxybenzaldehyde	0.62	View
205	2,2'-Methylenebis(4-chlorophenol)	3.09	View
206	2,4-Dinitrophenol	1.06	View
207	Hexylaldehyde	-0.19	View
208	Methylacetate	-2.00	View
209	Dibutyladipate	0.79	View
210	Diethylsebacate	1.35	View
211	2-(Ethylamino)ethanol	-0.76	View
212	Diethyladipate	-0.24	View
213	Diethylbenzylmalonate	0.71	View
214	Diethylphthalate	0.23	View
215	Dibutylphthalate	1.60	View
216	Ethylbenzoate	-0.01	View
217	Propylacetate	-1.24	View
218	Ethylhexanoate	0.06	View
219	Butylacetate	-0.49	View
220	Dimethylphthalate	-0.44	View
221	Ethylacetate	-1.30	View
222	Hexylacetate	-0.04	View
223	(tert)Butylacetate	-1.49	View
224	Diethylmalonate	-1.03	View
225	Isovaleraldehyde	-0.33	View
226	Dimethylnitroterephthalate	0.43	View
227	Dibutylsuccinate	0.51	View
228	Dibutylisophthalate	1.44	View
229	Propylamine	-0.71	View
230	Butylamine	-0.57	View
231	Amylamine	-0.48	View
232	Hexylamine	-0.22	View
233	Heptylamine	0.21	View
234	Octylamine	0.61	View
235	Nonulamine	1.70	View
236	Decylamine	2.06	View
237	Undecylamine	2.33	View
238	(+/-)-sec-Butylamine	-0.67	View
239	1,2-Diaminopropane	-0.56	View
240	1,3-Diaminopropane	-0.70	View
241	(+/-)-1,2-Dimethylpropylamine	-0.71	View
242	Pentachlorophenol	2.07	View
243	2,4-Dinitroaniline	0.72	View
244	2,4,6-Bromophenol	2.03	View
245	2,5-Dinitrophenol	0.95	View
246	4,6-Dinitro-2-methylphenol	1.73	View
247	2,6-Dinitrophenol	0.54	View
248	Pentabromophenol	2.66	View
249	2,3,4,6-Tetrachlorophenol	2.21	View
250	4-Phenylazophenol	1.66	View
251	Pentachloropyridine	1.71	View
252	2,3,5,6-Tetrachloroaniline	1.89	View
253	4-(tert)Butyl-2,6-dinitrophenol	1.80	View
254	2,3,4,5-Tetrachlorophenol	2.72	View
255	Allylisothiocyanate	2.06	View
256	2-Methyl-1,4-naphthquinone	1.54	View
257	4-Phenoxybenzaldehyde	1.26	View
258	Methylmethacrylate	-1.22	View
259	1-Chloro-2-nitrobenzene	0.63	View
260	Allylmethacrylate	-0.68	View
261	2-Methylbuteraldehyde	-0.39	View
262	4-Dimethlaminobenzaldhyde	0.23	View
263	1,4-Dinitrobenzene	1.30	View
264	Benzaldehyde	-0.01	View
265	4-Chlorobenzaldehyde	0.40	View
266	Isobutylacrylate	0.29	View
267	2-Propenal	1.41	View
268	3-Butenenitrile	-1.48	View
269	Valeraldehyde	-0.13	View
270	4-Amino-2-nitrophenol	0.88	View
271	2,4-Nitrotoluene	0.64	View
272	1-Chloro-3-nitrobenzene	0.73	View
273	2-Chloro-4-nitroaniline	0.75	View
274	4-Isopropylbenzaldehyde	0.67	View
275	2-Methylvaleraldehyde	-0.47	View
276	2,4-Pentanedione	-0.27	View
277	Butyraldehyde	-0.37	View
278	Ethylacrylate	0.52	View
279	2-Aminoethanol	-1.01	View
280	1-Fluoro-4-nitrobenzene	0.10	View
281	2-Fluorobenzaldehyde	0.08	View
282	3-Pyridincarboxaldehyde	-0.15	View
283	2-Tolualdehyde	-0.01	View
284	2-Nitrobenzaldehyde	0.17	View
285	4-Nitrobenzaldehyde	0.20	View
286	2,4-Dimethoxbenzaldehyde	-0.06	View
287	Methyl-4-nitrobenzoate	0.39	View
288	4-Nitrobenzamide	0.18	View
289	Pentafluorobenzaldehyde	0.82	View
290	Pentafluoroaniline	0.26	View
291	2-Hydroxyethylacrylate	0.69	View
292	2-Hydroxyethylmethacrylate	-1.08	View
293	2,4-Dichlorobenzaldehyde	1.04	View
294	2-Hydroxypropylacrylate	0.65	View
295	Tetrachlorocatechol	1.70	View
296	2-Ethoxyethylmethacrylate	-0.78	View
297	Benzylmethacrylate	0.65	View
298	N-Hexylacrylate	0.71	View
299	Cyclohexylacrylate	0.76	View
300	2,4,5-Trimethoxybenzaldehyde	-0.10	View
301	Isopropylmethacrylate	-0.88	View
302	2-Amino-5-chlorobenzonitrile	0.44	View
303	1,3,5-Trichloro-2,4-dinitrobenzene	2.19	View
304	2-Chloro-5-nitrobenzaldehyde	0.53	View
305	4-Ethoxybenzaldehyde	0.07	View
306	3-Hydroxy-2-nitropyridine	0.87	View
307	1,3-Dichloro-4,6-dinitrobenzene	2.60	View
308	5-Hydroxy-2-nitrobenzaldehyde	0.44	View
309	Methyl-2,5-dichlorobenzoate	0.81	View
310	2,3-Dibromopropanol	-0.49	View
311	3,5-Dibromo-4-hydroxybenzonitrile	1.16	View
312	2,4-Dichlorobenzamide	-0.36	View
313	Diethylchloromalonate	0.63	View
314	N-Vinylcarbazole	2.24	View
315	1,3-Dichloro-4,6-dinitrobenzene	2.57	View
316	2,2,2-Trichloroethanol	-0.46	View
317	2-Chloroethanol	-1.42	View
318	1-Chloro-2-propanol	-1.49	View
319	3-Chloro-1-propanol	-1.40	View
320	2,3,4,5,6-Pentafluoroaniline	0.20	View
321	2,2-Dichloroacetamide	-0.98	View
322	2-Chloro-6-methylbenzonitrile	0.46	View
323	4-Dimethylaminocinnamaldehyde	0.52	View
324	2-Propyn-1-ol	-0.74	View
325	2-Butyn-1,4-diol	-1.19	View
326	Catechol	0.75	View
327	2-Butyn-1-ol	-1.43	View
328	3-Butyn-1-ol	-1.84	View
329	2-Decyn-1-ol	0.99	View
330	3-Butyn-2-ol	-0.40	View
331	1,5-hexadien-3-ol	0.25	View
332	1-Amino-2-propanol	-0.93	View
333	Hexanoicacid	-0.20	View
334	Triethanolamine	-1.75	View
335	1-Amino-2-propanol	-0.93	View
336	Diethanolamine	-1.03	View
337	N,N-Diethylethanolamine	-1.50	View

Bibliography

Ren, S.; Frymier, P. D.; Schultz, T. W. An exploratory study of the use of multivariate techniques to determine mechanisms of toxic action. Ecotox. Environ. Saf. 2003, 55, 86–97. https://doi.org/10.1016/S0147-6513(02)00132-X

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Ren, S.; Frymier, P.D.; Schultz, T.W. An exploratory study of the use of multivariate techniques to determine mechanisms of toxic action. Ecotoxicol. Environ. Saf. 2003, 55, 1, 86–97.

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