Substrate
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Generation 1
XenoSite
Azure c cation
CNc1ccc2nc3ccc(N)cc3[s+]c2c1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
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Thionine(1+)
Nc1ccc2nc3ccc(N)cc3[s+]c2c1
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 2
Select a metabolite to form the next generation.
nitrogen oxidation
Probability 0.14
0.14
nitrogen oxidation
Probability 0.14
0.14
hydroxylation
Probability 0.11
0.11
hydroxylation
Probability 0.05
0.05
hydroxylation
Probability 0.05
0.05
Showing 5 of 66 metabolites
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