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:17252-51-6
Name:4,4'-Propane-1,3-diyldipyridine
Description:
Labels:eval
CAS:17252-51-6
InChi Code:InChI=1S/C13H14N2/c1(2-12-4-8-14-9-5-12)3-13-6-10-15-11-7-13/h4-11H,1-3H2

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.161504317

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