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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	CHEMBL3589950
Molecular formula	C32H33F5N2O3
IUPAC name	2-(4-fluorophenyl)-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-4-(6-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)butanamide
Molecular weight	588.619
Hydrogen bond acceptor	9
Hydrogen bond donor	1
XlogP	5.8
Synonyms	BDBM50098054
Inchi Key	JBPGVGKLUHRKDA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C32H33F5N2O3/c1-41-27-6-7-29-23(18-27)9-15-42-31(29)10-13-39(14-11-31)12-8-28(22-2-4-25(33)5-3-22)30(40)38-20-21-16-24(32(35,36)37)19-26(34)17-21/h2-7,16-19,28H,8-15,20H2,1H3,(H,38,40)
PubChem CID	122181236
ChEMBL	CHEMBL3589950
IUPHAR	N/A
BindingDB	50098054
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
481068	C-C chemokine receptor type 2	P51683	Ccr2	Mus musculus (Mouse)	373
481069	C-C chemokine receptor type 2	P41597	CCR2	Homo sapiens (Human)	374

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