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:88-86-8
Name:2,5-Dichloro-3-nitrobenzoic acid
Description:
Labels:eval
CAS:88-86-8
InChi Code:InChI=1S/C7H3Cl2NO4/c8-3-1-4(7(11)12)6(9)5(2-3)10(13)14/h1-2H,(H,11,12)

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.066396799

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