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:721929-01-7
Name:2,2'-[Propane-1,2-diylbis(oxy)]di(ethan-1-ol)
Description:
Labels:eval
CAS:721929-01-7
InChi Code:InChI=1S/C7H16O4/c1-7(11-5-3-9)6-10-4-2-8/h7-9H,2-6H2,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.004271147

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