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:1452-15-9
Name:4-Thiazolecarbonitrile
Description:
Labels:eval
CAS:1452-15-9
InChi Code:InChI=1S/C4H2N2S/c5-1-4-2-7-3-6-4/h2-3H

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.01751775

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