Azodopa

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Azodopa Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CN(C)CCc1ccccc1N=NC1=CC=C(O)C2(O)OC12 Quinonation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CN(C)CCC1=CC(=O)C(=O)C=C1N=NC1=CC=C(O)C2(O)OC12 N-Dealkylation prediction

Generation 3

Formic acid

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Formic acid stable oxygenation prediction

Formic acid unstable oxygenation prediction

Formic acid dehydrogenation prediction

Formic acid reduction prediction

Formic acid hydrolysis prediction

Generation 4

Select a metabolite to form the next generation.