Amrinone

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Amrinone stable oxygenation prediction

Amrinone unstable oxygenation prediction

Amrinone dehydrogenation prediction

Amrinone reduction prediction

Amrinone hydrolysis prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Nc1cc(-c2ccncc2O)c[nH]c1=O Quinonation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Nc1cc(C2=CC(=O)N=CC2=O)c[nH]c1=O N-Dealkylation prediction

Generation 3

dealkylation · 0.10

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

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