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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	Orexin receptor antagonist 17
Molecular formula	C21H21N7O3
IUPAC name	2-[(3R,6R)-1-[6-methoxy-2-(triazol-2-yl)pyridine-3-carbonyl]-6-methylpiperidin-3-yl]oxypyridine-4-carbonitrile
Molecular weight	419.445
Hydrogen bond acceptor	8
Hydrogen bond donor	0
XlogP	2.6
Synonyms	SCHEMBL14877107 CHEMBL3642130 US20130102619, 17 BDBM97385
Inchi Key	DGACJWNMJQVDSN-GDBMZVCRSA-N
Inchi ID	InChI=1S/C21H21N7O3/c1-14-3-4-16(31-19-11-15(12-22)7-8-23-19)13-27(14)21(29)17-5-6-18(30-2)26-20(17)28-24-9-10-25-28/h5-11,14,16H,3-4,13H2,1-2H3/t14-,16-/m1/s1
PubChem CID	71526393
ChEMBL	CHEMBL3642130
IUPHAR	N/A
BindingDB	97385
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
59060	Orexin receptor type 1	P56718	Hcrtr1	Rattus norvegicus (Rat)	416
59061	Orexin receptor type 1	O43613	HCRTR1	Homo sapiens (Human)	425
59062	Orexin receptor type 2	P56719	Hcrtr2	Rattus norvegicus (Rat)	460
59063	Orexin receptor type 2	O43614	HCRTR2	Homo sapiens (Human)	444

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