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
1,4-diphenylbenzene
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SMILES:
Ring Information
Rings
Ring Systems
Atoms
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3
3
18
18
0
0
0
Subset Information
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BB
In Man
Last Updated
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0
2
2
0
0
2012-03-23
Parents (
1 Total
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Benzene
No Child Rings
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
Description
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(Annotations)
CP2C9_HUMAN
P11712
CHEMBL3397
Cytochrome P450 2C9, Human
2
Annotations
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SMILES
SDF
Mol2
Flexibase
