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
7aH-benzofuran-2-one
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SMILES:
Ring Information
Rings
Ring Systems
Atoms
Carbons
Nitrogens
Oxygens
Sulfurs
2
1
10
8
0
2
0
Subset Information
Substances
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BB
In Man
Last Updated
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0
0
4
0
0
2012-03-30
Parents (
2 Total
)
2H-furan-5-one
5-methylenecyclohexa-1,3-diene
Children (
1 Total
)
6-(2-morpholinoethyliminomethyl)…
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
Description
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Download
(Annotations)
Z103205
Z103205
CHEMBL1075390
A431
4
Annotations
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SMILES
SDF
Mol2
Flexibase
