Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Acecainidum
CCN(CC)CCNC(=O)c1ccc(NC(C)=O)cc1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
Show metabolites
CC(=O)Nc1ccc(C(N)=O)cc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 2
Show metabolites
CC(=O)NC12C=CC(C(N)=O)=CC1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 3
Show metabolites
CC(=O)NC12C=CC(C(N)=O)CC1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 4
Select a metabolite to form the next generation.
n dealkylation
Probability 0.95
0.95
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Acetamide
n dealkylation
Probability 0.95
0.95
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n dealkylation
Probability 0.05
0.05
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n dealkylation
Probability 0.05
0.05
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((sup 13)n)ammonia
n dealkylation
Probability 0.01
0.01
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(11c)acetic acid
Showing 5 of 6 metabolites
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