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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	CHEMBL3663526
Molecular formula	C21H20F3N7O2
IUPAC name	[2-methoxy-6-(triazol-2-yl)phenyl]-[2-[[5-(trifluoromethyl)pyrazin-2-yl]amino]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
Molecular weight	459.433
Hydrogen bond acceptor	10
Hydrogen bond donor	1
XlogP	2.9
Synonyms	US9062078, 242 BDBM164112 SCHEMBL16081374
Inchi Key	BFRKOXFSGJNCQG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H20F3N7O2/c1-33-16-4-2-3-15(31-27-7-8-28-31)19(16)20(32)30-12-5-6-14(30)13(9-12)29-18-11-25-17(10-26-18)21(22,23)24/h2-4,7-8,10-14H,5-6,9H2,1H3,(H,26,29)
PubChem CID	90445377
ChEMBL	CHEMBL3663526
IUPHAR	N/A
BindingDB	164112
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
465691	Orexin receptor type 1	O43613	HCRTR1	Homo sapiens (Human)	425
517445	Orexin receptor type 1	P56718	Hcrtr1	Rattus norvegicus (Rat)	416
465692	Orexin receptor type 2	O43614	HCRTR2	Homo sapiens (Human)	444

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