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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	CHEMBL33929
Molecular formula	C29H37Cl2N2O2+
IUPAC name	2,7-dichloro-N-[1-(cyclooctylmethyl)-1-methylpiperidin-1-ium-4-yl]-9H-xanthene-9-carboxamide
Molecular weight	516.527
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	7.8
Synonyms	BDBM50098630 1-Cyclooctylmethyl-4-[(2,7-dichloro-9H-xanthene-9-carbonyl)-amino]-1-methyl-piperidinium; iodide CHEMBL1178597
Inchi Key	GAWADCCAEQQLNX-UHFFFAOYSA-O
Inchi ID	InChI=1S/C29H36Cl2N2O2/c1-33(19-20-7-5-3-2-4-6-8-20)15-13-23(14-16-33)32-29(34)28-24-17-21(30)9-11-26(24)35-27-12-10-22(31)18-25(27)28/h9-12,17-18,20,23,28H,2-8,13-16,19H2,1H3/p+1
PubChem CID	10580015
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50098630
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
91952	C-C chemokine receptor type 1	P32246	CCR1	Homo sapiens (Human)	355
460037	C-C chemokine receptor type 1	P51675	Ccr1	Mus musculus (Mouse)	355

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