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

Compound

	ID:	e3280
	Name:	Isobutyl nitrite
	Description:
	Labels:
	CAS:	542-56-3
	InChi Code:	InChI=1S/C4H9NO2/c1-4(2)3-7-5-6/h4H,3H2,1-2H3

Properties

Agonists: Activity in AR agonist pathway

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