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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	CHEMBL481197
Molecular formula	C21H30F3N3O3S
IUPAC name	(1S,4R)-7,7-dimethyl-1-[[(3S)-3-methyl-4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]sulfonylmethyl]bicyclo[2.2.1]heptan-2-ol
Molecular weight	461.544
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	3.4
Synonyms	BDBM50412555 SCHEMBL14465721
Inchi Key	ZNGVTBVYSZJBBY-PTZILIPGSA-N
Inchi ID	InChI=1S/C21H30F3N3O3S/c1-14-12-26(8-9-27(14)18-5-4-16(11-25-18)21(22,23)24)31(29,30)13-20-7-6-15(10-17(20)28)19(20,2)3/h4-5,11,14-15,17,28H,6-10,12-13H2,1-3H3/t14-,15+,17?,20+/m0/s1
PubChem CID	44570219
ChEMBL	CHEMBL481197
IUPHAR	N/A
BindingDB	50412555
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
432789	C-X-C chemokine receptor type 3	P49682	CXCR3	Homo sapiens (Human)	368
432790	C-X-C chemokine receptor type 3	O88410	Cxcr3	Mus musculus (Mouse)	367

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