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:657-84-1
Name:Sodium 4-methylbenzenesulfonate
Description:
Labels:training
CAS:657-84-1
InChi Code:InChI=1S/C7H8O3S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H,8,9,10)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.019577115

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