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:3068-88-0
Name:beta-Butyrolactone
Description:
Labels:eval
CAS:3068-88-0
InChi Code:InChI=1S/C4H6O2/c1-3-2-4(5)6-3/h3H,2H2,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.015089389

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