Garcia-Sosa, A. T.; Maran, U. Combined Naïve Bayesian, chemical fingerprints, and molecular docking classifiers to model and predict androgen receptor binding activity data for environmentally- and health-sensitive substances. Int. J. Mol. Sci. 2021, 22, 6695.

Compound

	ID:	297-76-7
	Name:	Ethynodiol diacetate
	Description:
	Labels:	eval
	CAS:	297-76-7
	InChi Code:	InChI=1S/C24H32O4/c1-5-24(28-16(3)26)13-11-22-21-8-6-17-14-18(27-15(2)25)7-9-19(17)20(21)10-12-23(22,24)4/h1,14,18-22H,6-13H2,2-4H3

Properties

BindingClass: Activity in Androgen Receptor

Value	Source or prediction
1	experimental value
0	Procedure_13: Multivariate Logistic Regression Model (Evaluation set)