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:4316-74-9
Name:Sodium 2-(methylamino)ethanesulfonate
Description:
Labels:eval
CAS:4316-74-9
InChi Code:InChI=1S/C3H9NO3S/c1-4-2-3-8(5,6)7/h4H,2-3H2,1H3,(H,5,6,7)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.006222152

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