10967/8 - QDB Compounds

QsarDB Repository

Schultz, T.W.; Cronin, M.T.D. Response-Surface Analyses for Toxicity to Tetrahymena pyriformis: Reactive Carbonyl-Containing Aliphatic Chemicals. J. Chem. Inf. Comput. Sci. 1999, 39, 2, 304–309.

Compound

ID:17
Name:2-methyl-2-butenal
Description:
Labels:
CAS:497-03-0
InChi Code:

Properties

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

ValueSource or prediction
-0.14

experimental value

0.44

1: All compounds (Training)

0.27

2: Selected compounds (Training)

Links to External Resources