10967/10 - QDB Compounds

QsarDB Repository

Cronin, M.T.D.; Schultz, T.W. Development of Quantitative Structure-Activity Relationships for the Toxicity of Aromatic Compounds to Tetrahymena pyriformis: Comparative Assessment of the Methodologies. Chem. Res. Toxicol. 2001, 14, 9, 1284–1295.

Compound

ID:257
Name:2,4,6-trichloro-1,3-dinitrobenzene
Description:
Labels:
CAS:
InChi Code:

Properties

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

ValueSource or prediction
2.19

Cronin, M. T. D.; Gregory, B. W.; Schultz, T. W. Quantitative Structure-Activity Analyses of Nitrobenzene Toxicity to Tetrahymena pyriformis. Chem. Res. Toxicol. 1998, 11, 902–908. http://dx.doi.org/10.1021/tx970166m

1.47

1: All compounds (Training)

1.54

2: Selected compounds (n = 253) (Training)

1.46

3: Selected compounds (n = 239) (Training)

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