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:38090-53-8
Name:(E)-4-amino-2-butenoic acid
Description:
Labels:eval
CAS:38090-53-8
InChi Code:InChI=1S/C4H7NO2/c5-3-1-2-4(6)7/h1-2H,3,5H2,(H,6,7)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.003848346

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