Substrate
/
Generation 1
XenoSite
Action
COC(=O)CSc1cc(N=c2sc(=O)n3n2CCCC3)c(F)cc1Cl
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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COC(=O)CSC1=CC(N=c2sc(=O)n3n2CCCC3)=C(F)C2OC12Cl
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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 0.32
0.32
dna
Probability 0.24
0.24
dna
Probability 0.24
0.24
glutathionation
Probability 0.18
0.18
protein
Probability 0.17
0.17
Showing 5 of 16 metabolites
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