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:108-65-6
Name:1-Methoxy-2-propyl acetate
Description:
Labels:eval
CAS:108-65-6
InChi Code:InChI=1S/C6H12O3/c1-5(4-8-3)9-6(2)7/h5H,4H2,1-3H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
1

experimental value

0.003815174

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