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:6837-24-7
Name:1-Cyclohexylpyrrolidin-2-one
Description:
Labels:eval
CAS:6837-24-7
InChi Code:InChI=1S/C10H17NO/c12-10-7-4-8-11(10)9-5-2-1-3-6-9/h9H,1-8H2

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.028759577

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