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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	CHEMBL268395
Molecular formula	C27H33N3O
IUPAC name	N-[(1R,2R)-2-aminocyclohexyl]-4-(1H-indol-3-yl)-N-[(E)-3-phenylprop-2-enyl]butanamide
Molecular weight	415.581
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	4.6
Synonyms	N-((1R,2R)-2-aminocyclohexyl)-N-cinnamyl-4-(1H-indol-3-yl)butanamide BDBM50217701
Inchi Key	CTWATJKCCUTZQI-OAOUBSARSA-N
Inchi ID	InChI=1S/C27H33N3O/c28-24-15-5-7-17-26(24)30(19-9-12-21-10-2-1-3-11-21)27(31)18-8-13-22-20-29-25-16-6-4-14-23(22)25/h1-4,6,9-12,14,16,20,24,26,29H,5,7-8,13,15,17-19,28H2/b12-9+/t24-,26-/m1/s1
PubChem CID	44434853
ChEMBL	CHEMBL268395
IUPHAR	N/A
BindingDB	50217701
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
50486	Melanocortin receptor 3	P41968	MC3R	Homo sapiens (Human)	323
50484	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
50485	Melanocortin receptor 5	P33032	MC5R	Homo sapiens (Human)	325
50487	Melanocyte-stimulating hormone receptor	Q01727	Mc1r	Mus musculus (Mouse)	315

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