ZINC
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ZINC ID or SMILES
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Bemis-Murcko Scaffolds
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Identity
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80%
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Substructure
Inden-1-one
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SMILES:
Ring Information
Rings
Ring Systems
Atoms
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Nitrogens
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2
1
10
9
0
1
0
Subset Information
Substances
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BB
In Man
Last Updated
View
1
28
1
2
1
2012-03-06
Parents (
2 Total
)
Cyclopenta-2,4-dien-1-one
Benzene
Children (
18 Total
)
2-phenylinden-1-one
2-(1H-pyrazol-5-yliminomethyl)in…
2-(phenyliminomethyl)inden-1-one
2-benzimidoylinden-1-one
2-(3-piperazinopropyl)inden-1-one
2-(benzyliminomethyl)inden-1-one
2-(phenethyliminomethyl)inden-1-one
2-(3-morpholinopropyliminomethyl…
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
Description
Size
Browse
Download
(Annotations)
LOX5_RAT
P12527
CHEMBL312
Arachidonate 5-lipoxygenase, Rat
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase