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:54982-83-1
Name:1,4-Dioxacyclohexadecane-5,16-dione
Description:
Labels:eval
CAS:54982-83-1
InChi Code:InChI=1S/C14H24O4/c15-13-9-7-5-3-1-2-4-6-8-10-14(16)18-12-11-17-13/h1-12H2

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.080338144

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