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:np111
Name:chlorobenzene
Description:
Labels:
CAS:108-90-7
InChi Code:InChI=1S/C6H5Cl/c7-6-4-2-1-3-5-6/h1-5H

Properties

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

ValueSource or prediction
-1.37

experimental value

-1.911

Tab3.Eq1: Nonpolar narcosis (Training set)

-1.908

QMRF1: Nonpolar narcosis (Training set)