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:67883-79-8
Name:(3Z)-Hex-3-en-1-yl (2E)-2-methylbut-2-enoate
Description:
Labels:eval
CAS:67883-79-8
InChi Code:InChI=1S/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5-7H,4,8-9H2,1-3H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.001846177

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