Substrate
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Generation 1
XenoSite
Astemizole
COc1ccc(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1
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 1
Show metabolites
Desmethylastemizole
Oc1ccc(CCN2CCC(Nc3nc4ccccc4n3Cc3ccc(F)cc3)CC2)cc1
CHEBI
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 2
Select a metabolite to form the next generation.
n dealkylation
Probability 0.82
0.82
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Tecastemizole
n dealkylation
Probability 0.82
0.82
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(<em>p</em>-hydroxyphenyl)acetic acid
n dealkylation
Probability 0.82
0.82
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P-hydroxyphenylacetaldehyde
n dealkylation
Probability 0.82
0.82
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Tyrosol
n dealkylation
Probability 0.47
0.47
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Showing 5 of 14 metabolites
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