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
Generation 1
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CCN1CCCC1CNC(=O)C1=CC(S(=O)(=O)CC)=C(N)C2OC12OC
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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
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CCS(=O)(=O)C1=C(N)C2OC2(OC)C(C(=O)NCC2CCCN2)=C1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Select a metabolite to form the next generation.
glutathionation
Probability 0.30
0.30
glutathionation
Probability 0.16
0.16
dna
Probability 0.16
0.16
protein
Probability 0.14
0.14
dna
Probability 0.12
0.12
Showing 5 of 12 metabolites
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