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:60676-84-8
Name:1-(7-Methoxy-1,3-benzodioxol-5-yl)propan-2-amine hydrochloride
Description:
Labels:eval
CAS:60676-84-8
InChi Code:InChI=1S/C11H15NO3/c1-7(12)3-8-4-9(13-2)11-10(5-8)14-6-15-11/h4-5,7H,3,6,12H2,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.055371834

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