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:3025-30-7
Name:Ethyl (2E,4Z)-deca-2,4-dienoate
Description:
Labels:training
CAS:3025-30-7
InChi Code:InChI=1S/C12H20O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h8-11H,3-7H2,1-2H3/b9-8-,11-10+

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.001820286

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