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:765-12-8
Name:3,6,9,12-Tetraoxatetradeca-1,13-diene
Description:
Labels:eval
CAS:765-12-8
InChi Code:InChI=1S/C10H18O4/c1-3-11-5-7-13-9-10-14-8-6-12-4-2/h3-4H,1-2,5-10H2

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.004067513

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