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
(phenylthio)BLAH
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SMILES:
Ring Information
Rings
Ring Systems
Atoms
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6
2
23
18
0
4
1
Subset Information
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BB
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2012-04-05
Parents (
2 Total
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Benzene
BLAH
No Child Rings
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
Description
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(Annotations)
Z81057
Z81057
CHEMBL613979
HUVEC (Umbilical Vein Endothelial Cells)
1
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SDF
Mol2
Flexibase
