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_4
Name:Di-n-pentyl phthalate
Description:
Labels:
CAS:131-18-0
InChi Code:InChI=1S/C18H26O4/c1-3-5-9-13-21-17(19)15-11-7-8-12-16(15)18(20)22-14-10-6-4-2/h7-8,11-12H,3-6,9-10,13-14H2,1-2H3

Properties

ER_activity: Estrogenic activity

ValueSource or prediction
Inactive

experimental value

Inactive

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