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:61570-90-9
Name:Tioxidazole
Description:
Labels:eval
CAS:61570-90-9
InChi Code:InChI=1S/C12H14N2O3S/c1-3-6-17-8-4-5-9-10(7-8)18-11(13-9)14-12(15)16-2/h4-5,7H,3,6H2,1-2H3,(H,13,14,15)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
1

experimental value
0.170473558

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