10967/9 - QDB Compounds

QsarDB Repository

Cronin, M.T.D.; Manga, N.; Seward, J.R.; Sinks, G.D.; Schultz, T.W. Parametrization of Electrophilicity for the Prediction of the Toxicity of Aromatic Compounds. Chem. Res. Toxicol. 2001, 14, 11, 1498–1505.

Compound

ID:203
Name:2,3,5,6-tetrachloro-1,4-dinitrobenzene
Description:
Labels:
CAS:20098-38-8
InChi Code:

Properties

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

ValueSource or prediction
2.74

experimental value

2.19

4: All compounds (Training)

2.57

7: All compounds (Training)

2.18

10: Selected compounds (Training)

2.56

11: Selected compounds (Training)