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:87-68-3
Name:Hexachloro-1,3-butadiene
Description:
Labels:training
CAS:87-68-3
InChi Code:InChI=1S/C4Cl6/c5-1(3(7)8)2(6)4(9)10

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.0064923

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