Amp morpholidate

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Amp morpholidate N-Dealkylation prediction

Generation 1

Adenine

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Adenine Quinonation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

NC1=NC(=O)N=C2NC(=O)N=C12 stable oxygenation prediction

NC1=NC(=O)N=C2NC(=O)N=C12 unstable oxygenation prediction

NC1=NC(=O)N=C2NC(=O)N=C12 dehydrogenation prediction

NC1=NC(=O)N=C2NC(=O)N=C12 reduction prediction

NC1=NC(=O)N=C2NC(=O)N=C12 hydrolysis prediction

Generation 3

dealkylation · 0.06

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=C1C(N)=NC(=O)N=C1NC(=O)O