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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	CHEMBL491506
Molecular formula	C21H21F2N3O5
IUPAC name	3-[[2-[[(1S)-2,2-difluoro-1-(3-methylfuran-2-yl)propyl]amino]-3,4-dioxocyclobuten-1-yl]amino]-2-hydroxy-N,N-dimethylbenzamide
Molecular weight	433.412
Hydrogen bond acceptor	9
Hydrogen bond donor	3
XlogP	3.2
Synonyms	BDBM50248402 (S)-3-(2-(2,2-difluoro-1-(3-methylfuran-2-yl)propylamino)-3,4-dioxocyclobut-1-enylamino)-2-hydroxy-N,N-dimethylbenzamide
Inchi Key	DABXGLPZDQYKGO-IBGZPJMESA-N
Inchi ID	InChI=1S/C21H21F2N3O5/c1-10-8-9-31-18(10)19(21(2,22)23)25-14-13(16(28)17(14)29)24-12-7-5-6-11(15(12)27)20(30)26(3)4/h5-9,19,24-25,27H,1-4H3/t19-/m0/s1
PubChem CID	44564998
ChEMBL	CHEMBL491506
IUPHAR	N/A
BindingDB	50248402
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
54885	C-X-C chemokine receptor type 1	P25024	CXCR1	Homo sapiens (Human)	350
54884	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360

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