Substrate
/
Generation 1
XenoSite
Acebutolol
CCCC(=O)Nc1ccc(OCC(O)CNC(C)C)c(C(C)=O)c1
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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Isopropanol
CC(C)O
CHEBI
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Description
▾
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.
hydroxylation
Probability 0.23
0.23
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(<i>s</i>)-propane-1,2-diol
hydroxylation
Probability 0.12
0.12
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dealkylation
Probability 0.03
0.03
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Formaldehyde
dealkylation
Probability 0.03
0.03
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A polyvinyl alcohol
dealkylation
Probability 0.03
0.03
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Methanol
Showing 5 of 10 metabolites
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