Amp morpholidate

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Amp morpholidate Quinonation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=C1N=CN=C2C1=NC(=O)N2C1OC(COP(=O)(O)N2CCOCC2)C(O)C1O stable oxygenation prediction

N=C1N=CN=C2C1=NC(=O)N2C1OC(COP(=O)(O)N2CCOCC2)C(O)C1O unstable oxygenation prediction

N=C1N=CN=C2C1=NC(=O)N2C1OC(COP(=O)(O)N2CCOCC2)C(O)C1O dehydrogenation prediction

N=C1N=CN=C2C1=NC(=O)N2C1OC(COP(=O)(O)N2CCOCC2)C(O)C1O reduction prediction

N=C1N=CN=C2C1=NC(=O)N2C1OC(COP(=O)(O)N2CCOCC2)C(O)C1O hydrolysis prediction

Generation 2

epoxidation · 0.08

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=C1C2=NC(=O)N(C3OC(COP(=O)(O)N4CCOCC4)C(O)C3O)C2=NC2ON12