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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL58619
Molecular formula	C19H15FN2O4S
IUPAC name	6-benzylsulfonyl-N-(4-fluorophenyl)-1-oxidopyridin-1-ium-3-carboxamide
Molecular weight	386.397
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	1.9
Synonyms	N-(4-Fluoro-phenyl)-1-oxy-6-phenylmethanesulfonyl-nicotinamide 2-(Benzylsulfonyl)-5-(4-fluorophenylaminocarbonyl)pyridine 1-oxide SCHEMBL3228272 BDBM50102226
Inchi Key	XUNMHDBDUOUNHX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H15FN2O4S/c20-16-7-9-17(10-8-16)21-19(23)15-6-11-18(22(24)12-15)27(25,26)13-14-4-2-1-3-5-14/h1-12H,13H2,(H,21,23)
PubChem CID	10200147
ChEMBL	CHEMBL58619
IUPHAR	N/A
BindingDB	50102226
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
401266	C-X-C chemokine receptor type 1	P25024	CXCR1	Homo sapiens (Human)	350
401264	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360
401265	Calcitonin receptor	P30988	CALCR	Homo sapiens (Human)	508
401262	Endothelin receptor type B	P24530	EDNRB	Homo sapiens (Human)	442
401261	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447
401263	Neuropeptide Y receptor type 1	P25929	NPY1R	Homo sapiens (Human)	384

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