Piir, G.; Sild, S.; Maran, U. Binary and multi-class classification for androgen receptor agonists, antagonists and binders. Chemosphere 2021, 262, 128313.

Compound

	ID:	e4550
	Name:	3,4-Hexanedione
	Description:
	Labels:
	CAS:	4437-51-8
	InChi Code:	InChI=1S/C6H10O2/c1-3-5(7)6(8)4-2/h3-4H2,1-2H3

Properties

Agonists: Activity in AR agonist pathway

Value	Source or prediction
inactive	experimental value
inactive	Agonists_model: Agonist model (Evaluation set)