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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	CHEMBL480016
Molecular formula	C21H27F4N3O3S
IUPAC name	(1S,4R)-1-[[(3S)-4-[3-fluoro-5-(trifluoromethyl)pyridin-2-yl]-3-methylpiperazin-1-yl]sulfonylmethyl]-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Molecular weight	477.519
Hydrogen bond acceptor	10
Hydrogen bond donor	0
XlogP	3.2
Synonyms	BDBM50254678 (1S,4R)-1-(((S)-4-(3-fluoro-5-(trifluoromethyl)pyridin-2-yl)-3-methylpiperazin-1-ylsulfonyl)methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Inchi Key	UIILMPGHICZFBB-LRDNONRASA-N
Inchi ID	InChI=1S/C21H27F4N3O3S/c1-13-11-27(6-7-28(13)18-16(22)8-15(10-26-18)21(23,24)25)32(30,31)12-20-5-4-14(9-17(20)29)19(20,2)3/h8,10,13-14H,4-7,9,11-12H2,1-3H3/t13-,14+,20+/m0/s1
PubChem CID	44570180
ChEMBL	CHEMBL480016
IUPHAR	N/A
BindingDB	50254678
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
337508	C-X-C chemokine receptor type 3	O88410	Cxcr3	Mus musculus (Mouse)	367
337509	C-X-C chemokine receptor type 3	P49682	CXCR3	Homo sapiens (Human)	368

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