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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	N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-[(1-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide
Molecular formula	C20H17N5OS2
IUPAC name	N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Molecular weight	407.51
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	4.8
Synonyms	MCULE-2591880070 ZINC2848071 N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide AKOS000414653 SMR000076046 CHEMBL1321699 MLS000097398 N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-[(1-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide AM-879/42240724 HMS2378N20 STL358527 MolPort-002-266-652 AC1M2W8G [ Show all ]
Inchi Key	ADAMSUNAJBIMOO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H17N5OS2/c1-14-7-9-15(10-8-14)17-11-27-20(22-17)23-18(26)12-28-19-21-13-25(24-19)16-5-3-2-4-6-16/h2-11,13H,12H2,1H3,(H,22,23,26)
PubChem CID	2202285
ChEMBL	CHEMBL1321699
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
2078	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371

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