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:5349-51-9
Name:4-(2-Methylbutan-2-yl)cyclohexanol
Description:
Labels:training
CAS:5349-51-9
InChi Code:InChI=1S/C11H22O/c1-4-11(2,3)9-5-7-10(12)8-6-9/h9-10,12H,4-8H2,1-3H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.02683925

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