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_7
Name:Di-iso-propyl adipate
Description:
Labels:
CAS:6938-94-9
InChi Code:InChI=1S/C12H22O4/c1-9(2)15-11(13)7-5-6-8-12(14)16-10(3)4/h9-10H,5-8H2,1-4H3

Properties

ER_activity: Estrogenic activity

ValueSource or prediction
Inactive

experimental value

Inactive

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