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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	CHEMBL1681848
Molecular formula	C29H31Cl2F2N5O
IUPAC name	5-chloro-6-[4-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]piperazin-1-yl]-N-[(3,4-difluorophenyl)methyl]pyridine-3-carboxamide
Molecular weight	574.498
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	5.4
Synonyms	SCHEMBL13205857 5-chloro-6-(4-(1-(4-chlorobenzyl)piperidin-4-yl)piperazin-1-yl)-N-(3,4-difluorobenzyl)nicotinamide BDBM50337217
Inchi Key	FMYKWJDOTAPBPQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C29H31Cl2F2N5O/c30-23-4-1-20(2-5-23)19-36-9-7-24(8-10-36)37-11-13-38(14-12-37)28-25(31)16-22(18-34-28)29(39)35-17-21-3-6-26(32)27(33)15-21/h1-6,15-16,18,24H,7-14,17,19H2,(H,35,39)
PubChem CID	53322504
ChEMBL	CHEMBL1681848
IUPHAR	N/A
BindingDB	50337217
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
82374	C-X-C chemokine receptor type 3	Q9JII9	Cxcr3	Rattus norvegicus (Rat)	367
82375	C-X-C chemokine receptor type 3	P49682	CXCR3	Homo sapiens (Human)	368
82376	C-X-C chemokine receptor type 3	O88410	Cxcr3	Mus musculus (Mouse)	367

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