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=CC=C(O)C2(O)OC12 stable oxygenation prediction

CN(C)CCc1ccccc1N=NC1=CC=C(O)C2(O)OC12 unstable oxygenation prediction

CN(C)CCc1ccccc1N=NC1=CC=C(O)C2(O)OC12 dehydrogenation prediction

CN(C)CCc1ccccc1N=NC1=CC=C(O)C2(O)OC12 reduction prediction

CN(C)CCc1ccccc1N=NC1=CC=C(O)C2(O)OC12 hydrolysis prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CN(C)CCc1ccccc1NNC1=CC=C(O)C2(O)OC12 gsh prediction

CN(C)CCc1ccccc1NNC1=CC=C(O)C2(O)OC12 protein prediction

CN(C)CCc1ccccc1NNC1=CC=C(O)C2(O)OC12 cyanide prediction

CN(C)CCc1ccccc1NNC1=CC=C(O)C2(O)OC12 dna prediction

Generation 3

dna · 0.11

*C1(O)C(O)=CC=C(NNc2ccccc2CCN(C)C)C1O |$DNA;;;;;;;;;;;;;;;;;;;;;;$|