Amrinone

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Amrinone Quinonation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=C1C(=O)NC=C(c2ccncc2)C1=O N-Dealkylation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=C(C(N)=O)C(=O)C(=CO)c1ccncc1 Epoxidation prediction

Generation 3

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=C(C(N)=O)C(=O)C(=CO)C1=CC2ON2C=C1 gsh prediction

N=C(C(N)=O)C(=O)C(=CO)C1=CC2ON2C=C1 protein prediction

N=C(C(N)=O)C(=O)C(=CO)C1=CC2ON2C=C1 cyanide prediction

N=C(C(N)=O)C(=O)C(=CO)C1=CC2ON2C=C1 dna prediction

Generation 4

Select a metabolite to form the next generation.