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:51460-26-5
Name:Carbazochrome sodium sulfonate
Description:
Labels:eval
CAS:51460-26-5
InChi Code:InChI=1S/C10H12N4O5S/c1-14-7-4-8(15)6(12-13-10(11)16)2-5(7)3-9(14)20(17,18)19/h2,4,6,9H,3H2,1H3,(H2,11,16)(H,17,18,19)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.012661867

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