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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	CHEMBL62228
Molecular formula	C25H32N6O2
IUPAC name	(2S)-N-(4-aminobutyl)-2-(3,4-dihydro-1H-isoquinolin-2-ylcarbamoylamino)-3-(1H-indol-3-yl)propanamide
Molecular weight	448.571
Hydrogen bond acceptor	4
Hydrogen bond donor	5
XlogP	2.4
Synonyms	BDBM50129180 N-(4-Amino-butyl)-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-ureido]-3-(1H-indol-3-yl)-propionamide
Inchi Key	BLQZIVNHYRDWGF-QHCPKHFHSA-N
Inchi ID	InChI=1S/C25H32N6O2/c26-12-5-6-13-27-24(32)23(15-20-16-28-22-10-4-3-9-21(20)22)29-25(33)30-31-14-11-18-7-1-2-8-19(18)17-31/h1-4,7-10,16,23,28H,5-6,11-15,17,26H2,(H,27,32)(H2,29,30,33)/t23-/m0/s1
PubChem CID	44305770
ChEMBL	CHEMBL62228
IUPHAR	N/A
BindingDB	50129180
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
26905	Melanocortin receptor 3	P33033	Mc3r	Mus musculus (Mouse)	323
26906	Melanocortin receptor 4	P56450	Mc4r	Mus musculus (Mouse)	332
26907	Melanocortin receptor 5	P41149	Mc5r	Mus musculus (Mouse)	325
26904	Melanocyte-stimulating hormone receptor	Q01727	Mc1r	Mus musculus (Mouse)	315

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