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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-(2-furylBLAHyl)-3-phenyl-urea
PubMed
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SMILES:
Ring Information
Rings
Ring Systems
Atoms
Carbons
Nitrogens
Oxygens
Sulfurs
5
3
27
17
8
2
0
Subset Information
Substances
Natural
Purchasable
Annotated
BB
In Man
Last Updated
View
0
0
6
0
0
2012-03-23
Parents (
3 Total
)
Furan
Benzene
BLAH
No Child Rings
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
Description
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Browse
Download
(Annotations)
AA1R_HUMAN
P30542
CHEMBL226
Adenosine A1 Receptor, Human
6
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
AA2AR_HUMAN
P29274
CHEMBL251
Adenosine A2a Receptor, Human
6
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
AA2BR_HUMAN
P29275
CHEMBL255
Adenosine A2b Receptor, Human
6
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
AA3R_HUMAN
P33765
CHEMBL256
Adenosine A3 Receptor, Human
6
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
AA3R_HUMAN
P33765
CHEMBL256
Adenosine A3 Receptor, Human
6
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
AA2AR_HUMAN
P29274
CHEMBL251
Adenosine A2a Receptor, Human
5
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
AA1R_HUMAN
P30542
CHEMBL226
Adenosine A1 Receptor, Human
4
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
AA2BR_HUMAN
P29275
CHEMBL255
Adenosine A2b Receptor, Human
4
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
AA3R_HUMAN
P33765
CHEMBL256
Adenosine A3 Receptor, Human
2
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase