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:6965-71-5
Name:alpha-(2,5-Dichlorophenoxy)propionic acid
Description:
Labels:eval
CAS:6965-71-5
InChi Code:InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-4-6(10)2-3-7(8)11/h2-5H,1H3,(H,12,13)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.20954345

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