10967/11 - QDB Compounds

QsarDB Repository

Schultz, T.W.; Cronin, M.T.D.; Netzeva, T.I.; Aptula, A.O. Structure-Toxicity Relationships for Aliphatic Chemicals Evaluated with Tetrahymena pyriformis. Chem. Res. Toxicol. 2002, 15, 12, 1602–1609.

Compound

ID:471
Name:heptanoyl chloride
Description:
Labels:
CAS:2528-61-2
InChi Code:

Properties

MOA: Mode of action

ValueSource or prediction
SN2 halo-activation

experimental value

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

ValueSource or prediction
0.4592

experimental value

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