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:148081-72-5
Name:1-O-Hexyl-2,3,5-trimethylhydroquinone
Description:
Labels:eval
CAS:148081-72-5
InChi Code:InChI=1S/C15H24O2/c1-5-6-7-8-9-17-14-10-11(2)15(16)13(4)12(14)3/h10,16H,5-9H2,1-4H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
1

experimental value

0.178252429

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