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:62-50-0
Name:Ethyl methanesulfonate
Description:
Labels:eval
CAS:62-50-0
InChi Code:InChI=1S/C3H8O3S/c1-3-6-7(2,4)5/h3H2,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.004354331

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