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:10222-01-2
Name:2,2-Dibromo-3-nitrilopropionamide
Description:
Labels:training
CAS:10222-01-2
InChi Code:InChI=1S/C3H2Br2N2O/c4-3(5,1-6)2(7)8/h(H2,7,8)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.002501801

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