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:81-84-5
Name:1H,3H-Naphtho(1,8-cd)pyran-1,3-dione
Description:
Labels:eval
CAS:81-84-5
InChi Code:InChI=1S/C12H6O3/c13-11-8-5-1-3-7-4-2-6-9(10(7)8)12(14)15-11/h1-6H

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.135427135

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