Abediterol

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Abediterol N-Dealkylation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

NCC(O)c1ccc(O)c2[nH]c(=O)ccc12 Quinonation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

NCC(O)=C1C=CC(=O)c2[nH]c(=O)ccc21 stable oxygenation prediction

NCC(O)=C1C=CC(=O)c2[nH]c(=O)ccc21 unstable oxygenation prediction

NCC(O)=C1C=CC(=O)c2[nH]c(=O)ccc21 dehydrogenation prediction

NCC(O)=C1C=CC(=O)c2[nH]c(=O)ccc21 reduction prediction

NCC(O)=C1C=CC(=O)c2[nH]c(=O)ccc21 hydrolysis prediction

Generation 3

Molecule must have at least 2 atoms: O