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:98-56-6
Name:1-Chloro-4-(trifluoromethyl)benzene
Description:
Labels:training
CAS:98-56-6
InChi Code:InChI=1S/C7H4ClF3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.249302335

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