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
3-[4-(4-phenoxybutoxy)phenyl]-1-phenyl-prop-2-en-1-one
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SMILES:
Ring Information
Rings
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Atoms
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3
3
28
25
0
3
0
Subset Information
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BB
In Man
Last Updated
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0
0
3
0
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2012-03-30
Parents (
1 Total
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Benzene
No Child Rings
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
Description
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(Annotations)
CLTR1_HUMAN
Q9Y271
CHEMBL1798
Cysteinyl Leukotriene Receptor 1, Human
3
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SMILES
SDF
Mol2
Flexibase