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:1985-51-9
Name:2,2-Dimethylpropane-1,3-diyl bis(2-methylprop-2-enoate)
Description:
Labels:eval
CAS:1985-51-9
InChi Code:InChI=1S/C13H20O4/c1-9(2)11(14)16-7-13(5,6)8-17-12(15)10(3)4/h1,3,7-8H2,2,4-6H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.002478295

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