10967/217 - QDB Compounds

QsarDB Repository

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:232
Name:Ethyl acrylate
Description:
Labels:
CAS:140-88-5
InChi Code:InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h3H,1,4H2,2H3

Properties

MCGM: Mammalian cell gene mutation test class

ValueSource or prediction
mutagen

experimental value

mutagen

Eq5: Model for α,β-unsaturated carbonyl compounds (Test set)