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:136-25-4
Name:Erbon
Description:
Labels:eval
CAS:136-25-4
InChi Code:InChI=1S/C11H9Cl5O3/c1-11(15,16)10(17)19-3-2-18-9-5-7(13)6(12)4-8(9)14/h4-5H,2-3H2,1H3
Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value
0.229999345

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