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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	CHEMBL230722
Molecular formula	C29H32F4N2O
IUPAC name	(1S,3R)-N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-methyl-3-[(1S,3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentane-1-carboxamide
Molecular weight	500.582
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	6.5
Synonyms	BDBM50212140 (1S,3R)-N-{[3-fluoro-5-(trifluoromethyl)phenyl]methyl}-1-methyl-3-[(1S,5''R)-5''-methylspiro[indene-1,4''-piperidine]-1''-yl]cyclopentane-1-carboxamide
Inchi Key	LMCGEWVHFZFMRY-JVRHDVHHSA-N
Inchi ID	InChI=1S/C29H32F4N2O/c1-19-18-35(12-11-28(19)10-7-21-5-3-4-6-25(21)28)24-8-9-27(2,16-24)26(36)34-17-20-13-22(29(31,32)33)15-23(30)14-20/h3-7,10,13-15,19,24H,8-9,11-12,16-18H2,1-2H3,(H,34,36)/t19-,24+,27-,28+/m0/s1
PubChem CID	44425643
ChEMBL	CHEMBL230722
IUPHAR	N/A
BindingDB	50212140
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
190790	C-C chemokine receptor type 2	P41597	CCR2	Homo sapiens (Human)	374
190791	C-C chemokine receptor type 2	P51683	Ccr2	Mus musculus (Mouse)	373

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