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_301
Name:Di-iso-propyl phthalate
Description:
Labels:
CAS:605-45-8
InChi Code:InChI=1S/C14H18O4/c1-9(2)17-13(15)11-7-5-6-8-12(11)14(16)18-10(3)4/h5-10H,1-4H3

Properties

ER_activity: Estrogenic activity

ValueSource or prediction
Active

experimental value

Inactive

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