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:131341-86-1
Name:Fludioxonil
Description:
Labels:training
CAS:131341-86-1
InChi Code:InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value
0.163147207

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