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:p42
Name:2,2-bis(4-hydroxyphenyl)propane
Description:
Labels:
CAS:80-05-7
InChi Code:InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3

Properties

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

ValueSource or prediction
-2.96

experimental value

-2.682

Tab3.Eq2: Polar narcosis (Training set)

-2.613

QMRF2: Polar narcosis (Training set)