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:	99-54-7
	Name:	3,4-Dichloronitrobenzene
	Description:
	Labels:	training
	CAS:	99-54-7
	InChi Code:	InChI=1S/C6H3Cl2NO2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H

Properties

bindingClass: Androgen Receptor Binding Class

Value	Source or prediction
0	experimental value
0.073938879	Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)