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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	MLS000037230
Molecular formula	C16H16N2O5S2
IUPAC name	N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
Molecular weight	380.433
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	1.2
Synonyms	CCG-25136 MolPort-002-598-219 SR-01000002162 2-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)-N-{2-[(2-furylmethyl)sulfanyl]ethyl}acetamide 644957-76-6 cid_662420 N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide ZINC2065684 AKOS001696156 NCGC00020273-02 N-[2-(2-furanylmethylthio)ethyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide SR-01000002162-2 2-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)-N-{2-[(2-furylmethyl)thio]ethyl}acetamide AC1LD7D6 HMS2462P03 N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide BDBM59616 MLS002582879 SMR000036380 CHEMBL1347805 N-[2-(2-furfurylthio)ethyl]-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetamide STK946782 2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-{2-[(furan-2-ylmethyl)sulfanyl]ethyl}acetamide AH-487/42142711 MCULE-7177563845 NCGC00020273-01 [ Show all ]
Inchi Key	AEGKXBLYXZRJOF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H16N2O5S2/c19-15(17-7-9-24-11-12-4-3-8-23-12)10-18-16(20)13-5-1-2-6-14(13)25(18,21)22/h1-6,8H,7,9-11H2,(H,17,19)
PubChem CID	662420
ChEMBL	CHEMBL1347805
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
463302	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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