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

Compound

	ID:	e2434
	Name:	Valeronitrile
	Description:
	Labels:
	CAS:	110-59-8
	InChi Code:	InChI=1S/C5H9N/c1-2-3-4-5-6/h2-4H2,1H3

Properties

Agonists: Activity in AR agonist pathway

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