10967/32 - QDB Compounds

QsarDB Repository

Ren, S.; Frymier, P.D.; Schultz, T.W. An exploratory study of the use of multivariate techniques to determine mechanisms of toxic action. Ecotoxicol. Environ. Saf. 2003, 55, 1, 86–97.

Compound

ID:327
Name:2-Butyn-1-ol
Description:
Labels:
CAS:764-01-2
InChi Code:

Properties

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

ValueSource or prediction
-1.43

experimental value

pLC50: 96-h Fathead minnow toxicity as log(1/LC50)

ValueSource or prediction
0.84

experimental value

MOA: Mode of action

ValueSource or prediction
Pro-electrophile

experimental value

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