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:109423-22-5
Name:5-Methyl-2-(propan-2-yl)cyclohexyl 2-hydroxybenzoate
Description:
Labels:eval
CAS:109423-22-5
InChi Code:InChI=1S/C17H24O3/c1-11(2)13-9-8-12(3)10-16(13)20-17(19)14-6-4-5-7-15(14)18/h4-7,11-13,16,18H,8-10H2,1-3H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.266092952

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