Substrate
/
Generation 1
XenoSite
Azumolene
O=C1CN(N=Cc2ncc(-c3ccc(Br)cc3)o2)C(=O)N1
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
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O=C(O)NC(=O)CNN=Cc1ncc(-c2ccc(Br)cc2)o1
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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 2
Select a metabolite to form the next generation.
hydrolysis
Probability 0.45
0.45
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hydrolysis
Probability 0.45
0.45
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Carbonic acid
hydrolysis
Probability 0.45
0.45
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Formic acid
epoxidation
Probability 0.19
0.19
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hydrolysis
Probability 0.18
0.18
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Carbamic acid
Showing 5 of 101 metabolites
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