10967/234 - QDB Compounds

QsarDB Repository

Garcia-Sosa, A. T.; Maran, U. Using combined docking, chemical fingerprints, and Bayesian classifiers for the androgen receptor binding activity of the CoMPARA data. Toxicological Sciences 2020.

Compound

ID:91-15-6
Name:1,2-Benzenedicarbonitrile
Description:
Labels:eval
CAS:91-15-6
InChi Code:InChI=1S/C8H4N2/c9-5-7-3-1-2-4-8(7)6-10/h1-4H

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.035332236

Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)