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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	CHEMBL1681858
Molecular formula	C24H29Cl2N5O2
IUPAC name	5-chloro-6-[(3S)-4-[1-[(4-chlorophenyl)methyl]-2-oxopiperidin-4-yl]-3-methylpiperazin-1-yl]-N-methylpyridine-3-carboxamide
Molecular weight	490.429
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	3.2
Synonyms	BDBM50337226 5-chloro-6-((3S)-4-(1-(4-chlorobenzyl)-2-oxopiperidin-4-yl)-3-methylpiperazin-1-yl)-N-methylnicotinamide
Inchi Key	ASJOUHJGEOKEFO-DJZRFWRSSA-N
Inchi ID	InChI=1S/C24H29Cl2N5O2/c1-16-14-30(23-21(26)11-18(13-28-23)24(33)27-2)9-10-31(16)20-7-8-29(22(32)12-20)15-17-3-5-19(25)6-4-17/h3-6,11,13,16,20H,7-10,12,14-15H2,1-2H3,(H,27,33)/t16-,20?/m0/s1
PubChem CID	53318561
ChEMBL	CHEMBL1681858
IUPHAR	N/A
BindingDB	50337226
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
13215	C-X-C chemokine receptor type 3	P49682	CXCR3	Homo sapiens (Human)	368

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