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)CCC1=CC2OC2C=C1N=Nc1ccc(O)c(O)c1 stable oxygenation prediction

CN(C)CCC1=CC2OC2C=C1N=Nc1ccc(O)c(O)c1 unstable oxygenation prediction

CN(C)CCC1=CC2OC2C=C1N=Nc1ccc(O)c(O)c1 dehydrogenation prediction

CN(C)CCC1=CC2OC2C=C1N=Nc1ccc(O)c(O)c1 reduction prediction

CN(C)CCC1=CC2OC2C=C1N=Nc1ccc(O)c(O)c1 hydrolysis prediction

Generation 2

Formaldehyde

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Formaldehyde N-Dealkylation prediction