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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	CHEMBL137344
Molecular formula	C27H34N4O2S
IUPAC name	(2S,5R)-5-(4-aminobutyl)-2-(1H-indol-3-ylmethyl)-7-(2-phenylethyl)-1,4,7-thiadiazonane-3,6-dione
Molecular weight	478.655
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	3.8
Synonyms	(2S,5R)-5-(4-Amino-butyl)-2-(1H-indol-3-ylmethyl)-7-phenethyl-[1,4,7]thiadiazonane-3,6-dione BDBM50082010 (6R,9S)-4-Phenethyl-6-(4-aminobutyl)-9-[(1H-indole-3-yl)methyl]-1-thia-4,7-diazacyclononane-5,8-dione
Inchi Key	AAFBBYLIBYKZEB-RPBOFIJWSA-N
Inchi ID	InChI=1S/C27H34N4O2S/c28-14-7-6-12-24-27(33)31(15-13-20-8-2-1-3-9-20)16-17-34-25(26(32)30-24)18-21-19-29-23-11-5-4-10-22(21)23/h1-5,8-11,19,24-25,29H,6-7,12-18,28H2,(H,30,32)/t24-,25+/m1/s1
PubChem CID	9982536
ChEMBL	CHEMBL137344
IUPHAR	N/A
BindingDB	50082010
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
159	Melanocyte-stimulating hormone receptor	Q01727	Mc1r	Mus musculus (Mouse)	315

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