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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	CHEMBL3691840
Molecular formula	C22H18BrFN4O2
IUPAC name	[6-(5-bromopyridin-2-yl)oxy-2-azabicyclo[2.2.1]heptan-2-yl]-(2-fluoro-6-pyrimidin-2-ylphenyl)methanone
Molecular weight	469.314
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	3.7
Synonyms	US8969352, 47 BDBM143786 SCHEMBL16089433
Inchi Key	DZJNFUJQJJPNEW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H18BrFN4O2/c23-14-5-6-19(27-11-14)30-18-10-13-9-17(18)28(12-13)22(29)20-15(3-1-4-16(20)24)21-25-7-2-8-26-21/h1-8,11,13,17-18H,9-10,12H2
PubChem CID	90452188
ChEMBL	CHEMBL3691840
IUPHAR	N/A
BindingDB	143786
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
471895	Orexin receptor type 1	P56718	Hcrtr1	Rattus norvegicus (Rat)	416
517691	Orexin receptor type 1	O43613	HCRTR1	Homo sapiens (Human)	425
471896	Orexin receptor type 2	O43614	HCRTR2	Homo sapiens (Human)	444

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