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:87-02-5
Name:7-Amino-4-hydroxynaphthalene-2-sulfonic acid
Description:
Labels:eval
CAS:87-02-5
InChi Code:InChI=1S/C10H9NO4S/c11-7-1-2-9-6(3-7)4-8(5-10(9)12)16(13,14)15/h1-5,12H,11H2,(H,13,14,15)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
1

experimental value

0.098108497

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