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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	CHEMBL397550
Molecular formula	C34H46ClN3O3
IUPAC name	N-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-4-(1H-indol-3-yl)butanamide
Molecular weight	580.21
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	6.8
Synonyms	BDBM50217644 N-(2-chloro-4,5-dimethoxybenzyl)-N-(4-((4-aminocyclohexyl)methyl)cyclohexyl)-4-(1H-indol-3-yl)butanamide
Inchi Key	CAGGFSBFLDCAIQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C34H46ClN3O3/c1-40-32-19-26(30(35)20-33(32)41-2)22-38(28-16-12-24(13-17-28)18-23-10-14-27(36)15-11-23)34(39)9-5-6-25-21-37-31-8-4-3-7-29(25)31/h3-4,7-8,19-21,23-24,27-28,37H,5-6,9-18,22,36H2,1-2H3
PubChem CID	44434762
ChEMBL	CHEMBL397550
IUPHAR	N/A
BindingDB	50217644
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
37137	Melanocortin receptor 3	P41968	MC3R	Homo sapiens (Human)	323
37134	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
37135	Melanocortin receptor 5	P33032	MC5R	Homo sapiens (Human)	325
37136	Melanocyte-stimulating hormone receptor	Q01727	Mc1r	Mus musculus (Mouse)	315

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