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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	SMR000020966
Molecular formula	C22H21N3O4S
IUPAC name	2-[[5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(2-methylphenyl)acetamide
Molecular weight	423.487
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	2.4
Synonyms	2-{[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydro-2-pyridinyl]sulfanyl}-N~1~-(2-methylphenyl)acetamide MolPort-001-906-246 A2374/0100396 HMS2297I20 2-[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-6-oxo(2-1,4,5-trihydropyridylthio)]-N -(2-methylphenyl)acetamide AKOS022015664 MLS000043756 ST050882 2-{[3-cyano-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide CHEMBL1391298 Oprea1_145867 AC1MJCUZ HMS638M15 SR-01000531222 2-[[5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(2-methylphenyl)acetamide BAS 01889450 MLS002585777 STK725919 5-cyano-4-(4-hydroxy-3-methoxyphenyl)-6-(2-methylphenyl)carbamoylmethylthio-1,2,3,4-tetra-hydropyridin-2-one ChemDiv1_018231 Oprea1_342574 2-[3-Cyano-4-(4-hydroxy-3-methoxy-phenyl)-6-oxo-1,4,5,6-tetrahydro-pyridin-2-yls AKOS001739544 MCULE-4937197957 SR-01000531222-1 [ Show all ]
Inchi Key	ACQANESRNJDMRM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H21N3O4S/c1-13-5-3-4-6-17(13)24-21(28)12-30-22-16(11-23)15(10-20(27)25-22)14-7-8-18(26)19(9-14)29-2/h3-9,15,26H,10,12H2,1-2H3,(H,24,28)(H,25,27)
PubChem CID	3135447
ChEMBL	CHEMBL1391298
IUPHAR	N/A
BindingDB	N/A
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
1779	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463

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