Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Antazoline
c1ccc(CN(CC2=NCCN2)c2ccccc2)cc1
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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Generation 1
Show metabolites
CC1=NCCN1
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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
CC12NCCN1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 3
Show metabolites
CC1(N)ON1CCO
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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 4
Select a metabolite to form the next generation.
dealkylation
Probability 0.63
0.63
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dealkylation
Probability 0.63
0.63
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Glycolic acid
dealkylation
Probability 0.63
0.63
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Glycolaldehyde
dealkylation
Probability 0.63
0.63
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Macrogol
nitrogen reduction
Probability 0.44
0.44
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Showing 5 of 33 metabolites
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