Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Amperozide cation
CCNC(=O)N1CC[NH+](CCCC(c2ccc(F)cc2)c2ccc(F)cc2)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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NC(=O)N1CC[NH+](CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
NC(=O)N1CC[NH+](CCCC(c2ccc(F)cc2)C23C=CC(F)=CC2O3)CC1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
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NC(=O)N1CC[NH+](CCCC(=C2C=CC(=O)C=C2)C23C=CC(F)=CC2O3)CC1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 4
Select a metabolite to form the next generation.
dna
Probability 0.23
0.23
dna
Probability 0.21
0.21
glutathionation
Probability 0.17
0.17
protein
Probability 0.13
0.13
protein
Probability 0.11
0.11
Showing 5 of 16 metabolites
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