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:5460-09-3
Name:4-Amino-5-hydroxy-2,7-naphthalenedisulfonic acid monosodium salt
Description:
Labels:eval
CAS:5460-09-3
InChi Code:InChI=1S/C10H9NO7S2/c11-8-3-6(19(13,14)15)1-5-2-7(20(16,17)18)4-9(12)10(5)8/h1-4,12H,11H2,(H,13,14,15)(H,16,17,18)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.091828925

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