Amrinone

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Amrinone N-Dealkylation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=CC=C(C=C=O)c1c[nH]c(=O)c(N)c1 stable oxygenation prediction

N=CC=C(C=C=O)c1c[nH]c(=O)c(N)c1 unstable oxygenation prediction

N=CC=C(C=C=O)c1c[nH]c(=O)c(N)c1 dehydrogenation prediction

N=CC=C(C=C=O)c1c[nH]c(=O)c(N)c1 reduction prediction

N=CC=C(C=C=O)c1c[nH]c(=O)c(N)c1 hydrolysis prediction

Generation 2

Select a metabolite to form the next generation.

Showing 5 of 64 metabolites