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:86-16-8
Name:4-(2,5-Diethoxy-4-nitrophenyl)morpholine
Description:
Labels:eval
CAS:86-16-8
InChi Code:InChI=1S/C14H20N2O5/c1-3-20-13-10-12(16(17)18)14(21-4-2)9-11(13)15-5-7-19-8-6-15/h9-10H,3-8H2,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.062717511

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