ZINC
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ZINC ID or SMILES
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Bemis-Murcko Scaffolds
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Identity
99%
90%
80%
70%
Substructure
N-(3-imidazol-1-ylpropyl)-1-phenyl-cyclobutanecarbothioamide
PubMed
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SMILES:
Ring Information
Rings
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Atoms
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3
3
21
17
3
0
1
Subset Information
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BB
In Man
Last Updated
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0
0
1
0
0
2012-04-04
Parents (
3 Total
)
Cyclobutane
Glyoxaline
Benzene
No Child Rings
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
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(Annotations)
QPCT_HUMAN
Q16769
CHEMBL4508
Glutaminyl-peptide Cyclotransferase, Human
1
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SDF
Mol2
Flexibase
