Azocarmine g free acid

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Azocarmine g free acid Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=S(=O)(O)c1ccc2c3nc4ccccc4n(-c4ccccc4)c-3cc(=NC3=CC4OC4(S(=O)(=O)O)C=C3)c2c1 N-Dealkylation prediction

Generation 2

dealkylation · 0.02

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=S(=O)(O)c1ccc2c3nc4ccccc4[nH]c-3cc(=NC3=CC4OC4(S(=O)(=O)O)C=C3)c2c1