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:91-23-6
Name:1-Methoxy-2-nitrobenzene
Description:
Labels:eval
CAS:91-23-6
InChi Code:InChI=1S/C7H7NO3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.074163238

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