Substrate
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Generation 1
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Generation 2
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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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 1
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CC(=O)Nc1ccc(C(=O)NCCO)cc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 2
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CC(=O)NC12C=CC(C(=O)NCCO)=CC1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 3
Select a metabolite to form the next generation.
n dealkylation
Probability 0.93
0.93
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Acetamide
n dealkylation
Probability 0.93
0.93
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n dealkylation
Probability 0.71
0.71
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n dealkylation
Probability 0.71
0.71
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Glycolic acid
n dealkylation
Probability 0.71
0.71
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Glycolaldehyde
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