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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	SCHEMBL13207037
Molecular formula	C21H27N5O4S
IUPAC name	3-[[4-[[(1R)-1-(4,5-dimethylfuran-2-yl)-2-methylpropyl]amino]-1-oxo-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N-dimethylbenzamide
Molecular weight	445.538
Hydrogen bond acceptor	7
Hydrogen bond donor	3
XlogP	3.3
Synonyms	BDBM50227005 3-{4-[(R)-1-(4,5-dimethyl-furan-2-yl)-2-methyl-propylamino]-1-oxo-1H-1lambda4-[1,2,5]thiadiazol-3-ylamino}-2-hydroxy-N,N-dimethyl-benzamide
Inchi Key	GEWHNBHOBDABRZ-WYXXSATOSA-N
Inchi ID	InChI=1S/C21H27N5O4S/c1-11(2)17(16-10-12(3)13(4)30-16)23-20-19(24-31(29)25-20)22-15-9-7-8-14(18(15)27)21(28)26(5)6/h7-11,17,27H,1-6H3,(H,22,24)(H,23,25)/t17-,31?/m1/s1
PubChem CID	135457545
ChEMBL	CHEMBL254943
IUPHAR	N/A
BindingDB	50227005
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
560246	C-X-C chemokine receptor type 1	P25024	CXCR1	Homo sapiens (Human)	350
560247	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360

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