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:7152-80-9
Name:4-(Dimethylamino)phenylthiocyanate
Description:
Labels:eval
CAS:7152-80-9
InChi Code:InChI=1S/C9H10N2S/c1-11(2)8-3-5-9(6-4-8)12-7-10/h3-6H,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
1

experimental value

0.034499509

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