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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	CHEMBL428022
Molecular formula	C23H26ClN3O
IUPAC name	N-(2-aminoethyl)-N-[(Z)-2-chloro-3-phenylprop-2-enyl]-4-(1H-indol-3-yl)butanamide
Molecular weight	395.931
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	3.9
Synonyms	BDBM50217673 (Z)-N-(2-aminoethyl)-N-(2-chloro-3-phenylallyl)-4-(1H-indol-3-yl)butanamide
Inchi Key	CCKWXYYVMDONEI-HKWRFOASSA-N
Inchi ID	InChI=1S/C23H26ClN3O/c24-20(15-18-7-2-1-3-8-18)17-27(14-13-25)23(28)12-6-9-19-16-26-22-11-5-4-10-21(19)22/h1-5,7-8,10-11,15-16,26H,6,9,12-14,17,25H2/b20-15-
PubChem CID	44434572
ChEMBL	CHEMBL428022
IUPHAR	N/A
BindingDB	50217673
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
38694	Melanocortin receptor 3	P41968	MC3R	Homo sapiens (Human)	323
38695	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
38693	Melanocyte-stimulating hormone receptor	Q01727	Mc1r	Mus musculus (Mouse)	315

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