M. Kemény

Read-across for the prediction of genotoxicity of dimethenamid-P groundwater metabolites: A case study using synthetic chemistry and computational toxicology.

This work presents a read-across case study to predict the genotoxicity of two previously untested groundwater metabolites of dimethenamid-P (α-chloroacetamide herbicide). Due to synthesis challenges, direct testing of the metabolites was not feasible. Structural space alerts and matched molecular pairs analysis were e...