Substrate
/
Generation 1
/
Generation 2
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
Generation 1
Show metabolites
COc1ccc(CCN2CCC(Nc3nc4ccccc4n3C=C3C=CC(=O)C=C3)CC2)cc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
COc1ccc(CCN2CCC(Nc3nc4ccccc4n3C=C3C=CC(=O)C4OC34)CC2)cc1
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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 0.92
0.92
Homoanisic acid
dealkylation
Probability 0.92
0.92
dealkylation
Probability 0.92
0.92
dealkylation
Probability 0.92
0.92
dealkylation
Probability 0.68
0.68
Showing 5 of 18 metabolites
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