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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	CHEMBL216602
Molecular formula	C20H21N3O5
IUPAC name	2-hydroxy-N,N-dimethyl-3-[[2-[[(1R)-1-(5-methylfuran-2-yl)ethyl]amino]-3,4-dioxocyclobuten-1-yl]amino]benzamide
Molecular weight	383.404
Hydrogen bond acceptor	7
Hydrogen bond donor	3
XlogP	2.6
Synonyms	SCHEMBL12262705 (R)-2-hydroxy-N,N-dimethyl-3-(2-(1-(5-methylfuran-2-yl)ethylamino)-3,4-dioxocyclobut-1-enylamino)benzamide BDBM50200886
Inchi Key	ACYREHAZQPOKBX-LLVKDONJSA-N
Inchi ID	InChI=1S/C20H21N3O5/c1-10-8-9-14(28-10)11(2)21-15-16(19(26)18(15)25)22-13-7-5-6-12(17(13)24)20(27)23(3)4/h5-9,11,21-22,24H,1-4H3/t11-/m1/s1
PubChem CID	16098481
ChEMBL	CHEMBL216602
IUPHAR	N/A
BindingDB	50200886
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
2034	C-X-C chemokine receptor type 1	P25024	CXCR1	Homo sapiens (Human)	350
2033	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360

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