10967/213 - QDB Compounds

QsarDB Repository

Saliner, A. G.; Netzeva, T. I.; Worth, A. P. Prediction of estrogenicity: validation of a classification model. SAR QSAR Environ. Res. 2006, 17, 195–223.

Compound

ID:v_326
Name:Coumestrol
Description:
Labels:
CAS:479-13-0
InChi Code:InChI=1S/C15H8O5/c16-7-1-3-9-11(5-7)19-14-10-4-2-8(17)6-12(10)20-15(18)13(9)14/h1-6,16-17H

Properties

ER_activity: Estrogenic activity

ValueSource or prediction
Active

experimental value

Active

Figure.1: Classification model for estrogenic activity (Validation set)