Piir, G.; Sild, S.; Maran, U. Interpretable machine learning for the identification of estrogen receptor agonists, antagonists, and binders. Chemosphere 2023.

Compound

	ID:	e2994
	Name:	2,2,2-Trichloroacetamide
	Description:
	Labels:
	CAS:	594-65-0
	InChi Code:	InChI=1S/C2H2Cl3NO/c3-2(4,5)1(6)7/h(H2,6,7)

Properties

er_ant: Activity in ER antagonist pathway

Value	Source or prediction
inactive	experimental value
inactive	Tab3.antagonists: Model for ER activity on antagonists pathway (Evaluation set)