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:	830-89-7
	Name:	Albutoin
	Description:
	Labels:	eval
	CAS:	830-89-7
	InChi Code:	InChI=1S/C10H16N2OS/c1-4-5-12-9(13)8(6-7(2)3)11-10(12)14/h4,7-8H,1,5-6H2,2-3H3,(H,11,14)

Properties

bindingClass: Androgen Receptor Binding Class

Value	Source or prediction
0	experimental value
0.011699847	Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)