Amrinone

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Amrinone Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Nc1cc(C2=CC=NC3OC23)c[nH]c1=O Quinonation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=C1C=C(C2=CC=NC3OC23)C(=O)NC1=O stable oxygenation prediction

N=C1C=C(C2=CC=NC3OC23)C(=O)NC1=O unstable oxygenation prediction

N=C1C=C(C2=CC=NC3OC23)C(=O)NC1=O dehydrogenation prediction

N=C1C=C(C2=CC=NC3OC23)C(=O)NC1=O reduction prediction

N=C1C=C(C2=CC=NC3OC23)C(=O)NC1=O hydrolysis prediction

Generation 3

Select a metabolite to form the next generation.