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_183
Name:1,6-Dinitropyrene
Description:
Labels:
CAS:42397-64-8
InChi Code:InChI=1S/C16H8N2O4/c19-17(20)13-8-4-10-2-6-12-14(18(21)22)7-3-9-1-5-11(13)16(10)15(9)12/h1-8H

Properties

ER_activity: Estrogenic activity

ValueSource or prediction
Inactive

experimental value

Inactive

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