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:93-72-1
Name:2-(2,4,5-Trichlorophenoxy)propionic acid
Description:
Labels:eval
CAS:93-72-1
InChi Code:InChI=1S/C9H7Cl3O3/c1-4(9(13)14)15-8-3-6(11)5(10)2-7(8)12/h2-4H,1H3,(H,13,14)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.069883343

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