Alogliptin

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Alogliptin Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Cn1c(=O)cc(N2CCCC(N)C2)n(CC2=CC=CC3OC23C#N)c1=O stable oxygenation prediction

Cn1c(=O)cc(N2CCCC(N)C2)n(CC2=CC=CC3OC23C#N)c1=O unstable oxygenation prediction

Cn1c(=O)cc(N2CCCC(N)C2)n(CC2=CC=CC3OC23C#N)c1=O dehydrogenation prediction

Cn1c(=O)cc(N2CCCC(N)C2)n(CC2=CC=CC3OC23C#N)c1=O reduction prediction

Cn1c(=O)cc(N2CCCC(N)C2)n(CC2=CC=CC3OC23C#N)c1=O hydrolysis prediction

Generation 2

dealkylation · 0.12

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Cn1c(=O)cc(N2CCCC(=O)C2)n(CC2=CC=CC3OC23C#N)c1=O