Substrate
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Generation 1
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Generation 2
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Generation 3
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Generation 4
XenoSite
Amfepramonum
CCN(CC)C(C)C(=O)c1ccccc1
CHEBI
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Description
▾
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
CCNC(C)C(=O)c1ccccc1
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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
1-aminoethyl phenyl ketone
CC(N)C(=O)c1ccccc1
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 3
Show metabolites
CC(N)C(=O)C1=CC=CC2OC12
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Show metabolites
CC(N)C(=O)C1=C2OC2C=CC1=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 5
Maximum generation reached — metabolites here can't start another hop.
n dealkylation
Probability 0.57
0.57
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n dealkylation
Probability 0.57
0.57
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n dealkylation
Probability 0.57
0.57
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((sup 13)n)ammonia
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