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:3965-55-7
Name:Sodium 3,5-bis(methoxycarbonyl)benzenesulfonate
Description:
Labels:eval
CAS:3965-55-7
InChi Code:InChI=1S/C10H10O7S/c1-16-9(11)6-3-7(10(12)17-2)5-8(4-6)18(13,14)15/h3-5H,1-2H3,(H,13,14,15)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.017982414

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