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:	111-55-7
	Name:	1,2-Ethanediol diacetate
	Description:
	Labels:	training
	CAS:	111-55-7
	InChi Code:	InChI=1S/C6H10O4/c1-5(7)9-3-4-10-6(2)8/h3-4H2,1-2H3

Properties

bindingClass: Androgen Receptor Binding Class

Value	Source or prediction
0	experimental value
0.001879845	Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)