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)C1=CC(=O)C(N=Nc2ccc(O)c(C(=O)O)c2)=CC1=O N-Dealkylation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

NC(=O)C1=CC(=O)C(N=Nc2ccc(O)c(C(=O)O)c2)=CC1=O UGT Conjugation prediction

Generation 3

glucuronidation · 0.28

*OC(=O)c1cc(N=NC2=CC(=O)C(C(N)=O)=CC2=O)ccc1O |$GlcA;;;;;;;;;;;;;;;;;;;;;;;$|