Barasertibum

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Barasertibum Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CCN(CCCOc1ccc2c(Nc3cc(CC(=O)NC4=CC=CC5(F)OC45)[nH]n3)ncnc2c1)CCOP(=O)(O)O N-Dealkylation prediction

Generation 2

1,2-ethanediol, 1-(dihydrogen phosphate)

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

1,2-ethanediol, 1-(dihydrogen phosphate) stable oxygenation prediction

1,2-ethanediol, 1-(dihydrogen phosphate) unstable oxygenation prediction

1,2-ethanediol, 1-(dihydrogen phosphate) dehydrogenation prediction

1,2-ethanediol, 1-(dihydrogen phosphate) reduction prediction

1,2-ethanediol, 1-(dihydrogen phosphate) hydrolysis prediction

Generation 3

Select a metabolite to form the next generation.

Showing 5 of 21 metabolites