Substrate
/
Generation 1
XenoSite
Azaperone
O=C(CCCN1CCN(c2ccccn2)CC1)c1ccc(F)cc1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
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O=C1C=CC(=[N+]2CCN(CCCC(=O)c3ccc(F)cc3)CC2)N=C1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 2
Select a metabolite to form the next generation.
dehydration
Probability 0.39
0.39
15o
dehydration
Probability 0.39
0.39
hydrogenation
Probability 0.39
0.39
oxygen reduction
Probability 0.39
0.39
dealkylation
Probability 0.34
0.34
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