Amrinone

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Amrinone Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

NC12OC1C(c1ccncc1)=CNC2=O Quinonation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

NC12OC1C(C1=CC(=O)N=CC1=O)=CNC2=O stable oxygenation prediction

NC12OC1C(C1=CC(=O)N=CC1=O)=CNC2=O unstable oxygenation prediction

NC12OC1C(C1=CC(=O)N=CC1=O)=CNC2=O dehydrogenation prediction

NC12OC1C(C1=CC(=O)N=CC1=O)=CNC2=O reduction prediction

NC12OC1C(C1=CC(=O)N=CC1=O)=CNC2=O hydrolysis prediction

Generation 3

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

NC12OC1C(C1=CC(=O)N=CC1O)=CNC2=O N-Dealkylation prediction

Generation 4

dealkylation · 0.16

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=CC(O)C(=CC(=O)O)C1=CNC(=O)C2(N)OC12