Substrate
/
Generation 1
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Generation 2
XenoSite
Apr
CC(=O)C1=NCCC1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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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
Show metabolites
CC(=O)C1=NCC=C1
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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)C12C=CCN1O2
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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 0.90
0.90
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n dealkylation
Probability 0.90
0.90
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n dealkylation
Probability 0.90
0.90
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n dealkylation
Probability 0.42
0.42
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