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:6285-05-8
Name:Ethyl 4-chlorophenyl ketone
Description:
Labels:training
CAS:6285-05-8
InChi Code:InChI=1S/C9H9ClO/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.105414642

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