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:1917-15-3
Name:5-Methyl-2-furancarboxylic acid
Description:
Labels:eval
CAS:1917-15-3
InChi Code:InChI=1S/C6H6O3/c1-4-2-3-5(9-4)6(7)8/h2-3H,1H3,(H,7,8)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.024540208

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