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:3878-80-6
Name:1-Ethylpyridinium trifluoromethanesulfonate
Description:
Labels:eval
CAS:3878-80-6
InChi Code:InChI=1S/C7H10N/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3/q+1

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.009488607

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