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Bearden, A.P.; Schultz, T.W. Structure-Activity Relationships for Pimephales and Tetrahymena: a Mechanism of Action Approach. Environ. Toxicol. Chem. 1997, 16, 6, 1311–1317.

93 compounds | Property pIGC50: 2-day Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]

ID Name pIGC50 Details
1 Phenol -0.32 View
2 o-Cresol -0.29 View
3 p-Cresol -0.16 View
4 2,4-Dimethylphenol 0.14 View
5 2,4,6-Trimethylphenol 0.42 View
6 2,3,6-Trimethylphenol 0.28 View
7 4-Ethylphenol 0.21 View
8 4-Propylphenol 0.64 View
9 2-Methyl-3-butyn-2-ol -1.49 View
10 2-Allylphenol 0.33 View
11 4-Tert-butylphenol 0.91 View
12 4-Tert-pentylphenol 1.23 View
13 4-Phenylphenol 1.38 View
14 Catechol 0.28 View
15 Resorcinol -0.65 View
16 3-Methoxyphenol -0.33 View
17 4-Methoxyphenol -0.14 View
18 4-Phenoxyphenol 1.36 View
19 2-Chlorophenol 0.18 View
20 4-Chlorophenol 0.54 View
21 4-Chloro-3-methylphenol 0.80 View
22 4-Chlorocatechol 1.06 View
23 2,4-Dichlorophenol 1.04 View
24 2,4,6-Trichlorophenol 1.41 View
25 2,3,4,6-Tetrachlorophenol 2.21 View
26 2,3,4,5-Tetrachlorophenol 2.72 View
27 Tetrachlorocatechol 1.70 View
28 2,4,6-Tribromophenol 2.03 View
29 2-Nitrophenol 0.67 View
30 2,6-Dinitrophenol 0.54 View
31 2,5-Dinitrophenol 0.95 View
32 2,4-Dinitrophenol 1.10 View
33 (Tert)butyldinitrophenol 1.80 View
34 4,6-Dinitro-o-cresol 1.73 View
35 Aniline -0.23 View
36 4-Toluidine -0.05 View
37 4-Ethylaniline 0.05 View
38 4-Butylaniline 1.07 View
39 3-Benzyloxyaniline 0.88 View
40 4-Hexyloxyaniline 1.38 View
41 2-Chloroaniline -0.25 View
42 2,3,4-Trichloroaniline 1.35 View
43 2,3,5,6-Tetrachloroaniline 1.79 View
44 2,3,4,5,6-Pentafluoroaniline 0.20 View
45 α,α,α-4-Tetrafluoro-3-toluidine 0.77 View
46 α,α,α-4-Tetrafluoro-2-toluidine -0.02 View
47 4-Ethoxy-2-nitroaniline 0.76 View
48 Isopropylbenzene 0.69 View
49 1,2,4-Trimethylbenzene 0.78 View
50 Butylbenzene 1.25 View
51 Amylbenzene 1.79 View
52 Biphenyl 1.05 View
53 Chlorobenzene 0.13 View
54 1,2-Dichlorobenzene 1.97 View
55 1,2,4-Trichlorobenzene 1.08 View
56 1,2,4,5-Tetrachlorobenzene NTAS View
57 3,4-Dichlorotoluene 1.22 View
58 Pentachloropyridine 1.71 View
59 Bromobenzene 0.08 View
60 Nitrobenzene 0.14 View
61 3-Nitrotoluene 0.42 View
62 1-Fluoro-4-nitrobenzene 0.10 View
63 1-Chloro-3-nitrobenzene 0.73 View
64 1-Chloro-2-nitrobenzene 0.63 View
65 1,4-Dinitrobenzene 1.30 View
66 2,4-Dinitrotoluene 0.64 View
67 1,3-Dichloro-4,6-dinitrobenzene 2.60 View
68 1,3,5-Trichloro-2,4-dinitrobenzene 2.19 View
69 2-Butyn-1-ol -1.43 View
70 Cis-3-hexen-1-ol -0.81 View
71 1-Hexen-3-ol -0.81 View
72 4-Pentyn-2-ol -1.63 View
73 2-Phenyl-3-butyn-2-ol -0.18 View
74 2-Propyn-1-ol -0.74 View
75 3-Butyn-2-ol -0.40 View
76 2-Decyn-1-ol 0.98 View
77 3-Butyn-1-ol -1.84 View
78 2-Butyn-1,4-diol -1.19 View
79 4-Chloroaniline 1.36 View
80 4-Bromoaniline 1.01 View
81 4-Fluoroaniline 0.59 View
82 4-Nitroaniline 1.12 View
83 Pentachlorophenol 2.06 View
84 4-Nonylphenol 2.47 View
85 Pentabromophenol 2.66 View
86 3,4-Dichloroaniline 1.37 View
87 4-Octylaniline 2.43 View
88 4-Decylaniline NTAS View
89 2,4,6-Tri(tert)butylphenol 0.36 View
90 2,6-Di(tert)butyl-4-methylphenol 1.80 View
91 Pentachloroanisole NTAS View
92 Pentachlorobenzene NTAS View
93 4-Nitrophenol 1.42 View

Bibliography

  1. Bearden, A. P.; Schultz, T. W. Structure-Activity Relationships for Pimephales and Tetrahymena: a Mechanism of Action Approach. Environ. Toxicol. Chem. 1997, 16, 1311–1317. http://dx.doi.org/10.1002/etc.5620160629