Azodopa

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Azodopa Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CN(C)CCc1ccccc1N=NC1=CC2OC2(O)C(O)=C1 N-Dealkylation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CN(C)CCc1ccccc1N=N Quinonation prediction

Generation 3

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CN(C)CC=C1C=CC(=O)C=C1N=N gsh prediction

CN(C)CC=C1C=CC(=O)C=C1N=N protein prediction

CN(C)CC=C1C=CC(=O)C=C1N=N cyanide prediction

CN(C)CC=C1C=CC(=O)C=C1N=N dna prediction

Generation 4

glutathionation · 0.22

*C1C=C(O)C=C(N=N)C1=CCN(C)C |$GSH;;;;;;;;;;;;;;$|