Substrate
/
Generation 1
/
Generation 2
XenoSite
Amisulpride
CCN1CCCC1CNC(=O)c1cc(S(=O)(=O)CC)c(N)cc1OC
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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Generation 1
Show metabolites
CCN1CCCC1CNC(=O)C12C=C(S(=O)(=O)CC)C(N)=CC1(OC)O2
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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 2
Show metabolites
CCS(=O)(=O)C1=CC2(C(=O)NCC3CCCN3)OC2(OC)C=C1N
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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 3
Select a metabolite to form the next generation.
glutathionation
Probability 0.02
0.02
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protein
Probability 0.01
0.01
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dna
Probability 0.01
0.01
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cyanide
Probability 0.00
0.00
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