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:821-06-7
Name:(E)-1,4-Dibromo-2-butene
Description:
Labels:eval
CAS:821-06-7
InChi Code:InChI=1S/C4H6Br2/c5-3-1-2-4-6/h1-2H,3-4H2

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.001904467

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