Balsalazide

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Balsalazide Quinonation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=C(O)CCNC(=O)c1ccc(N=NC2=CC(C(=O)O)=C(O)C(=O)C2=O)cc1 Epoxidation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=C(O)CCNC(=O)c1ccc(N=NC23OC2C(C(=O)O)=C(O)C(=O)C3=O)cc1 UGT Conjugation prediction

Generation 3

glucuronidation · 0.15

*OC(=O)CCNC(=O)c1ccc(N=NC23OC2C(C(=O)O)=C(O)C(=O)C3=O)cc1 |$GlcA;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|