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:np145
Name:azulene
Description:
Labels:
CAS:275-51-4
InChi Code:InChI=1S/C10H8/c1-2-5-9-7-4-8-10(9)6-3-1/h1-8H

Properties

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

ValueSource or prediction
-2.10721

experimental value

-2.115

QMRF1: Nonpolar narcosis (Test set)