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:25152-85-6
Name:(3Z)-Hex-3-en-1-yl benzoate
Description:
Labels:eval
CAS:25152-85-6
InChi Code:InChI=1S/C13H16O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h3-7,9-10H,2,8,11H2,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.019978725

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