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:np35
Name:hexachloroethane
Description:
Labels:
CAS:67-72-1
InChi Code:InChI=1S/C2Cl6/c3-1(4,5)2(6,7)8

Properties

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

ValueSource or prediction
-2.59

experimental value

-3.001

Tab3.Eq1: Nonpolar narcosis (Training set)

-2.999

QMRF1: Nonpolar narcosis (Training set)