Azodopa

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Azodopa stable oxygenation prediction

Azodopa unstable oxygenation prediction

Azodopa dehydrogenation prediction

Azodopa reduction prediction

Azodopa hydrolysis prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CNCCc1ccccc1N=Nc1ccc(O)c(O)c1 Epoxidation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CNCCc1ccccc1N=NC1=CC2(O)OC2(O)C=C1 N-Dealkylation prediction

Generation 3

Formic acid

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Formic acid gsh prediction

Formic acid protein prediction

Formic acid cyanide prediction

Formic acid dna prediction

Generation 4

Select a metabolite to form the next generation.