10967/218 - QDB Compounds

QsarDB Repository

Claeys, L.; Iaccino, F.; Janssen, C. R.; Van Sprang, P.; Verdonck, F. Development and validation of a quantitative structure-activity relationship for chronic narcosis to fish. Environ. Toxicol. Chem. 2013, 32, 2217–2225.

Compound

ID:p30
Name:2,4-dichlorophenol
Description:
Labels:
CAS:120-83-2
InChi Code:InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H

Properties

NOEC: Chronic fish toxicity as logNOEC [log(mmol/L)]

ValueSource or prediction
-2.75

experimental value

-2.572

Tab3.Eq2: Polar narcosis (Training set)

-2.52

QMRF2: Polar narcosis (Training set)