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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	CHEMBL168613
Molecular formula	C37H38N4O4+2
IUPAC name	2-[4-[4-[3-[1-[4-(1,3-dioxoisoindol-2-yl)butyl]pyridin-1-ium-4-yl]propyl]pyridin-1-ium-1-yl]butyl]isoindole-1,3-dione
Molecular weight	602.735
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	5.4
Synonyms	CHEMBL1181373 2-{3-[4-(3-{1-[3-(1,3-dioxo-2,3-dihydro-1H-2-isoindolyl)propyl]-4-pyridiniumyl}propyl)-1-pyridiniumyl]propyl}-1,3-isoindolinedione; dibromide BDBM50074572 4,4'-Trimethylenebis[1-(4-phthalimidylbutyl)pyridinium]
Inchi Key	DQBFYPYEOZRLHH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C37H38N4O4/c42-34-30-12-1-2-13-31(30)35(43)40(34)22-7-5-20-38-24-16-28(17-25-38)10-9-11-29-18-26-39(27-19-29)21-6-8-23-41-36(44)32-14-3-4-15-33(32)37(41)45/h1-4,12-19,24-27H,5-11,20-23H2/q+2
PubChem CID	10509354
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50074572
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
66117	Muscarinic acetylcholine receptor M2	P06199	CHRM2	Sus scrofa (Pig)	466

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