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:np96
Name:2,3,7,8-tetrachlorodibenzo[b,e][1,4]dioxin
Description:
Labels:
CAS:1746-01-6
InChi Code:InChI=1S/C12H4Cl4O2/c13-5-1-9-10(2-6(5)14)18-12-4-8(16)7(15)3-11(12)17-9/h1-4H

Properties

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

ValueSource or prediction
-9.93

experimental value

-5.502

Tab3.Eq1: Nonpolar narcosis (Training set)

-5.499

QMRF1: Nonpolar narcosis (Training set)