Substrate
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Generation 1
XenoSite
Acemetacin
COc1ccc2c(c1)c(CC(=O)OCC(=O)O)c(C)n2C(=O)c1ccc(Cl)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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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 1
Show metabolites
Cc1c(CC(=O)OCC(=O)O)c2cc(O)ccc2n1C(=O)c1ccc(Cl)cc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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gsh
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protein
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cyanide
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dna
Generation 2
Select a metabolite to form the next generation.
dna
Probability 0.05
0.05
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glutathionation
Probability 0.04
0.04
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protein
Probability 0.03
0.03
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cyanide
Probability 0.00
0.00
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