ZINC
12
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ZINC ID or SMILES
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Identity
99%
90%
80%
70%
Substructure
4-(2,2-diphenylethyl)-5-(4-piperidyl)-4-isothiazolin-3-one
PubMed
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SMILES:
Ring Information
Rings
Ring Systems
Atoms
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4
4
26
22
2
1
1
Subset Information
Substances
Natural
Purchasable
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BB
In Man
Last Updated
View
0
0
1
0
0
2012-04-04
Parents (
3 Total
)
4-isothiazolin-3-one
Piperidine
Benzene
No Child Rings
Most Common Targets
Name
(Uniprot)
Swissprot
ChEMBL
Description
Size
Browse
Download
(Annotations)
GBRA1_HUMAN
P14867
CHEMBL1962
GABA Receptor Alpha-1 Subunit, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
GBRA1_RAT
P62813
CHEMBL343
GABA Receptor Alpha-1 Subunit, Rat
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
GBRA1_RAT
P62813
CHEMBL343
GABA Receptor Alpha-1 Subunit, Rat
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
GBRB3_HUMAN
P28472
CHEMBL1847
GABA Receptor Beta-3 Subunit, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
GBRB3_RAT
P63079
CHEMBL316
GABA Receptor Beta-3 Subunit, Rat
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
GBRB3_RAT
P63079
CHEMBL316
GABA Receptor Beta-3 Subunit, Rat
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
GBRG2_HUMAN
P18507
CHEMBL1788
GABA Receptor Gamma-2 Subunit, Human
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
GBRG2_RAT
P18508
CHEMBL297
GABA Receptor Gamma-2 Subunit, Rat
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase
GBRG2_RAT
P18508
CHEMBL297
GABA Receptor Gamma-2 Subunit, Rat
1
Annotations
Catalogs
SMILES
SDF
Mol2
Flexibase