Pérez-Garrido, A.; Helguera, A. M.; López, G. C.; Cordeiro, M. N. D. S.; Escudero, A. G. A topological substructural molecular design approach for predicting mutagenesis end-points of α, β-unsaturated carbonyl compounds. Toxicology 2010, 268, 64–77.

Compound

	ID:	28
	Name:	4-acetamidochalcone
	Description:
	Labels:
	CAS:	102059-18-7
	InChi Code:	InChI=1S/C17H15NO2/c1-13(19)18-16-10-7-14(8-11-16)9-12-17(20)15-5-3-2-4-6-15/h2-12H,1H3,(H,18,19)/b12-9+

Properties

AMES: Ames test mutagenicity class

Value	Source or prediction
mutagen	experimental value
non-mutagen	Eq6: Model for α,β-unsaturated carbonyl compounds (Training set)