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:106-36-5
Name:Propyl propionate
Description:
Labels:eval
CAS:106-36-5
InChi Code:InChI=1S/C6H12O2/c1-3-5-8-6(7)4-2/h3-5H2,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value
0.002307999

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