Aripiprazole

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Aripiprazole stable oxygenation prediction

Aripiprazole unstable oxygenation prediction

Aripiprazole dehydrogenation prediction

Aripiprazole reduction prediction

Aripiprazole hydrolysis prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=CCCCOc1ccc2c(c1)NC(=O)CC2 N-Dealkylation prediction

Generation 2

Select a metabolite to form the next generation.