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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	CHEMBL3589949
Molecular formula	C32H33F5N2O2
IUPAC name	2-(4-fluorophenyl)-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-4-(3-methylspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)butanamide
Molecular weight	572.62
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	6.3
Synonyms	BDBM50097894
Inchi Key	OVVRQDCJYWDMFV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C32H33F5N2O2/c1-21-16-24-4-2-3-5-29(24)31(41-21)11-14-39(15-12-31)13-10-28(23-6-8-26(33)9-7-23)30(40)38-20-22-17-25(32(35,36)37)19-27(34)18-22/h2-9,17-19,21,28H,10-16,20H2,1H3,(H,38,40)
PubChem CID	122181235
ChEMBL	CHEMBL3589949
IUPHAR	N/A
BindingDB	50097894
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
494095	C-C chemokine receptor type 2	P51683	Ccr2	Mus musculus (Mouse)	373
494096	C-C chemokine receptor type 2	P41597	CCR2	Homo sapiens (Human)	374

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