Abh

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Abh stable oxygenation prediction

Abh unstable oxygenation prediction

Abh dehydrogenation prediction

Abh reduction prediction

Abh hydrolysis prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

NC(O)CCCCB(O)O N-Dealkylation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

OB(O)CCCCC(O)O UGT Conjugation prediction

Generation 3

glucuronidation · 0.86

*OC(O)CCCCB(O)O |$GlcA;;;;;;;;;;$|