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:6338-41-6
Name:5-(Hydroxymethyl)-2-furoic acid
Description:
Labels:eval
CAS:6338-41-6
InChi Code:InChI=1S/C6H6O4/c7-3-4-1-2-5(10-4)6(8)9/h1-2,7H,3H2,(H,8,9)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.020085139

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