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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	CHEMBL3965807
Molecular formula	C35H50N10O8
IUPAC name	(2S,5R,8S,11S,18S)-18-[[(2S)-2-acetamidohexanoyl]amino]-5-benzyl-2-(1H-imidazol-5-ylmethyl)-8-methyl-3,6,9,15,19-pentaoxo-1,4,7,10,14-pentazacyclononadecane-11-carboxamide
Molecular weight	738.847
Hydrogen bond acceptor	9
Hydrogen bond donor	9
XlogP	-0.6
Synonyms	BDBM250664 SCHEMBL12092513 US9447148, 9.33 US9447148, 9.45
Inchi Key	AXUMKJXCWLWCCP-OWBGXZFCSA-N
Inchi ID	InChI=1S/C35H50N10O8/c1-4-5-11-25(41-21(3)46)32(50)43-26-12-13-29(47)38-15-14-24(30(36)48)42-31(49)20(2)40-34(52)27(16-22-9-7-6-8-10-22)44-35(53)28(45-33(26)51)17-23-18-37-19-39-23/h6-10,18-20,24-28H,4-5,11-17H2,1-3H3,(H2,36,48)(H,37,39)(H,38,47)(H,40,52)(H,41,46)(H,42,49)(H,43,50)(H,44,53)(H,45,51)/t20-,24-,25-,26-,27+,28-/m0/s1
PubChem CID	70660651
ChEMBL	CHEMBL3965807
IUPHAR	N/A
BindingDB	250664
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons.

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
536427	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
536426	Melanocyte-stimulating hormone receptor	Q01726	MC1R	Homo sapiens (Human)	317

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