Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Tenofovir
CC(Cn1cnc2c(N)ncnc21)OCP(=O)(O)O
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
Nc1ncnc2c1=NC(=O)N=2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 2
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Nc1ncnc2c1=[N+]([O-])C(=O)N=2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 3
Show metabolites
NC12[N-]C=NC3=NC(=O)[N+](=O)C31O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 4
Select a metabolite to form the next generation.
dealkylation
Probability 0.98
0.98
dealkylation
Probability 0.87
0.87
((sup 13)n)ammonia
dealkylation
Probability 0.87
0.87
dealkylation
Probability 0.46
0.46
dealkylation
Probability 0.24
0.24
Showing 5 of 9 metabolites
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