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:74341-83-6
Name:1-(1,3-Benzodioxol-5-yl)-N-hydroxypropan-2-amine hydrochloride
Description:
Labels:eval
CAS:74341-83-6
InChi Code:InChI=1S/C10H13NO3/c1-7(11-12)4-8-2-3-9-10(5-8)14-6-13-9/h2-3,5,7,11-12H,4,6H2,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.207745351

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