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:57-55-6
Name:1,2-Propylene glycol
Description:
Labels:training
CAS:57-55-6
InChi Code:InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.001374823

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