Bcig

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Bcig N-Dealkylation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Nc1ccc(Br)c(Cl)c1C(=CO)OC1OC(CO)C(O)C(O)C1O stable oxygenation prediction

Nc1ccc(Br)c(Cl)c1C(=CO)OC1OC(CO)C(O)C(O)C1O unstable oxygenation prediction

Nc1ccc(Br)c(Cl)c1C(=CO)OC1OC(CO)C(O)C(O)C1O dehydrogenation prediction

Nc1ccc(Br)c(Cl)c1C(=CO)OC1OC(CO)C(O)C(O)C1O reduction prediction

Nc1ccc(Br)c(Cl)c1C(=CO)OC1OC(CO)C(O)C(O)C1O hydrolysis prediction

Generation 2

Select a metabolite to form the next generation.

Showing 5 of 96 metabolites