Substrate
/
Generation 1
XenoSite
Apinocaltamide
N#Cc1ccc(Cn2ccc(NC(=O)Cc3ccc(C4(C(F)(F)F)CC4)cc3)n2)nc1
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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N#CC12C=CC(Cn3ccc(NC(=O)Cc4ccc(C5(C(F)(F)F)CC5)cc4)n3)=NC1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 2
Select a metabolite to form the next generation.
glutathionation
Probability 0.79
0.79
dna
Probability 0.29
0.29
protein
Probability 0.25
0.25
glutathionation
Probability 0.23
0.23
dna
Probability 0.21
0.21
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