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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	CHEMBL514318
Molecular formula	C27H42N4O4
IUPAC name	(3S,6S,9S,12S)-3-benzyl-6,9,12-tris[(2S)-butan-2-yl]-1,4,7,10-tetrazacyclododecane-2,5,8,11-tetrone
Molecular weight	486.657
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	4.5
Synonyms	BDBM50256706 Cyclo(L-Ile-L-Ile-L-Ile-L-Phe-) (3S,6S,9S,12S)-3-benzyl-6,9,12-tri-sec-butyl-1,4,7,10-tetraazacyclododecane-2,5,8,11-tetraone
Inchi Key	ZRUGSOVQAHAWHC-GSLJADNHSA-N
Inchi ID	InChI=1S/C27H42N4O4/c1-7-16(4)21-25(33)28-20(15-19-13-11-10-12-14-19)24(32)29-22(17(5)8-2)26(34)31-23(18(6)9-3)27(35)30-21/h10-14,16-18,20-23H,7-9,15H2,1-6H3,(H,28,33)(H,29,32)(H,30,35)(H,31,34)/t16-,17-,18-,20-,21-,22-,23-/m0/s1
PubChem CID	44572036
ChEMBL	CHEMBL514318
IUPHAR	N/A
BindingDB	50256706
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
435941	Galanin receptor type 1	Q62805	Galr1	Rattus norvegicus (Rat)	346
435940	Galanin receptor type 2	O08726	Galr2	Rattus norvegicus (Rat)	372

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