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:1210-39-5
Name:2-Propenal,3,3-diphenyl-
Description:
Labels:eval
CAS:1210-39-5
InChi Code:InChI=1S/C15H12O/c16-12-11-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12H

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
1

experimental value

0.086025668

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