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:103-59-3
Name:3-Phenylprop-2-en-1-yl 2-methylpropanoate
Description:
Labels:eval
CAS:103-59-3
InChi Code:InChI=1S/C13H16O2/c1-11(2)13(14)15-10-6-9-12-7-4-3-5-8-12/h3-9,11H,10H2,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.072090818

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