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:38716-68-6
Name:5-(Hydroxymethyl-2-furoyl)glycine
Description:
Labels:eval
CAS:38716-68-6
InChi Code:InChI=1S/C8H9NO5/c10-4-5-1-2-6(14-5)8(13)9-3-7(11)12/h1-2,10H,3-4H2,(H,9,13)(H,11,12)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.023184287

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