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:6378-25-2
Name:2,4,5-Trichlorobenzenesulfonic acid
Description:
Labels:eval
CAS:6378-25-2
InChi Code:InChI=1S/C6H3Cl3O3S/c7-3-1-5(9)6(2-4(3)8)13(10,11)12/h1-2H,(H,10,11,12)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.057760927

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