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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	CHEMBL3669050
Molecular formula	C20H19F3N6O2
IUPAC name	[(2S,3R)-2-methyl-3-[5-(trifluoromethyl)pyrimidin-2-yl]oxypiperidin-1-yl]-[2-(triazol-2-yl)phenyl]methanone
Molecular weight	432.407
Hydrogen bond acceptor	9
Hydrogen bond donor	0
XlogP	3.5
Synonyms	US9115117, 103 BDBM175201 SCHEMBL16030927
Inchi Key	FTQQHPMQVXWTDW-SUMWQHHRSA-N
Inchi ID	InChI=1S/C20H19F3N6O2/c1-13-17(31-19-24-11-14(12-25-19)20(21,22)23)7-4-10-28(13)18(30)15-5-2-3-6-16(15)29-26-8-9-27-29/h2-3,5-6,8-9,11-13,17H,4,7,10H2,1H3/t13-,17+/m0/s1
PubChem CID	90404845
ChEMBL	CHEMBL3669050
IUPHAR	N/A
BindingDB	175201
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
473649	Orexin receptor type 1	P56718	Hcrtr1	Rattus norvegicus (Rat)	416
517768	Orexin receptor type 1	O43613	HCRTR1	Homo sapiens (Human)	425
473648	Orexin receptor type 2	O43614	HCRTR2	Homo sapiens (Human)	444

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