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:616-21-7
Name:1,2-Dichlorobutane
Description:
Labels:eval
CAS:616-21-7
InChi Code:InChI=1S/C4H8Cl2/c1-2-4(6)3-5/h4H,2-3H2,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.004677401

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