Substrate
/
Generation 1
/
Generation 2
XenoSite
Azodopa
CN(C)CCc1ccccc1N=Nc1ccc(O)c(O)c1
CHEBI
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Description
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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 1
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C[N+](C)([O-])CCc1ccccc1N=Nc1ccc(O)c(O)c1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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C[N+](C)([O-])CCc1ccccc1N=NC1=CC2OC2(O)C(O)=C1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Select a metabolite to form the next generation.
dealkylation
Probability 0.09
0.09
dealkylation
Probability 0.09
0.09
dealkylation
Probability 0.06
0.06
Formaldehyde
dealkylation
Probability 0.06
0.06
dealkylation
Probability 0.06
0.06
Methanol
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