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:100-02-7
Name:4-Nitrophenol|Sodium 4-nitrophenolate
Description:
Labels:training
CAS:100-02-7
InChi Code:InChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.105677116

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