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:881-03-8
Name:1-Nitro-2-methylnaphthalene
Description:
Labels:eval
CAS:881-03-8
InChi Code:InChI=1S/C11H9NO2/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(13)14/h2-7H,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.090266926

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