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_13
Name:Di-n-hexyl phthalate
Description:
Labels:
CAS:84-75-3
InChi Code:InChI=1S/C20H30O4/c1-3-5-7-11-15-23-19(21)17-13-9-10-14-18(17)20(22)24-16-12-8-6-4-2/h9-10,13-14H,3-8,11-12,15-16H2,1-2H3

Properties

ER_activity: Estrogenic activity

ValueSource or prediction
Inactive

experimental value

Inactive

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