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:79-31-2
Name:2-Methylpropanoic acid
Description:
Labels:eval
CAS:79-31-2
InChi Code:InChI=1S/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.002341359

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