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:50505-88-9
Name:R-(-)-2,5-Dimethoxy-4-methylamphetamine hydrochloride
Description:
Labels:eval
CAS:50505-88-9
InChi Code:InChI=1S/C12H19NO2/c1-8-5-12(15-4)10(6-9(2)13)7-11(8)14-3/h5,7,9H,6,13H2,1-4H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.033179329

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