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:np97
Name:aroclor 1248
Description:
Labels:
CAS:12672-29-6
InChi Code:InChI=1S/C12H6Cl4/c13-9-1-7(2-10(14)5-9)8-3-11(15)6-12(16)4-8/h1-6H

Properties

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

ValueSource or prediction
-5.77

experimental value

-5.314

Tab3.Eq1: Nonpolar narcosis (Training set)

-5.311

QMRF1: Nonpolar narcosis (Training set)