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:np128
Name:5-chloro-2-(2,4-dichlorophenoxy)phenol
Description:
Labels:
CAS:3380-34-5
InChi Code:InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H

Properties

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

ValueSource or prediction
-3.93

experimental value

-3.622

Tab3.Eq1: Nonpolar narcosis (Test set)

-3.619

QMRF1: Nonpolar narcosis (Test set)