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:2318-25-4
Name:Ethyl 3-ethoxy-3-iminopropionate hydrochloride
Description:
Labels:eval
CAS:2318-25-4
InChi Code:InChI=1S/C7H13NO3/c1-3-10-6(8)5-7(9)11-4-2/h8H,3-5H2,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.001750018

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