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:118-88-7
Name:5-Amino-2-methylbenzenesulfonic acid
Description:
Labels:eval
CAS:118-88-7
InChi Code:InChI=1S/C7H9NO3S/c1-5-2-3-6(8)4-7(5)12(9,10)11/h2-4H,8H2,1H3,(H,9,10,11)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.023909692

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