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:	142-92-7
	Name:	Hexyl acetate
	Description:
	Labels:	eval
	CAS:	142-92-7
	InChi Code:	InChI=1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

Value	Source or prediction
0	experimental value
0.001262123	Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)