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:174899-72-0
Name:1-Ethyl-2,3-dimethylimidazolium trifluoromethanesulfonate
Description:
Labels:eval
CAS:174899-72-0
InChi Code:InChI=1S/C7H13N2/c1-4-9-6-5-8(3)7(9)2/h5-6H,4H2,1-3H3/q+1

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.03279093

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