Substrate
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Generation 1
XenoSite
Batimastat
CNC(=O)C(Cc1ccccc1)NC(=O)C(CC(C)C)C(CSc1cccs1)C(=O)NO
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
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CNC(=O)C(CC12C=CC=CC1O2)NC(=O)C(CC(C)C)C(CSc1cccs1)C(=O)NO
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 2
Select a metabolite to form the next generation.
n dealkylation
Probability 0.65
0.65
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Formaldehyde
n dealkylation
Probability 0.65
0.65
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n dealkylation
Probability 0.65
0.65
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Methanol
n dealkylation
Probability 0.65
0.65
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Formic acid
n dealkylation
Probability 0.43
0.43
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Showing 5 of 13 metabolites
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