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:	1929-77-7
	Name:	Vernolate
	Description:
	Labels:	training
	CAS:	1929-77-7
	InChi Code:	InChI=1S/C10H21NOS/c1-4-7-11(8-5-2)10(12)13-9-6-3/h4-9H2,1-3H3

Properties

bindingClass: Androgen Receptor Binding Class

Value	Source or prediction
0	experimental value
0.002961661	Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)