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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	CHEMBL472749
Molecular formula	C20H20FN3O5
IUPAC name	3-[[2-[[(1S,2S)-2-fluoro-1-(furan-2-yl)propyl]amino]-3,4-dioxocyclobuten-1-yl]amino]-2-hydroxy-N,N-dimethylbenzamide
Molecular weight	401.394
Hydrogen bond acceptor	8
Hydrogen bond donor	3
XlogP	2.6
Synonyms	3-(2-((1S,2S)-2-fluoro-1-(furan-2-yl)propylamino)-3,4-dioxocyclobut-1-enylamino)-2-hydroxy-N,N-dimethylbenzamide BDBM50248337
Inchi Key	GAXCFOGLVNGOBY-IINYFYTJSA-N
Inchi ID	InChI=1S/C20H20FN3O5/c1-10(21)14(13-8-5-9-29-13)23-16-15(18(26)19(16)27)22-12-7-4-6-11(17(12)25)20(28)24(2)3/h4-10,14,22-23,25H,1-3H3/t10-,14+/m0/s1
PubChem CID	44564943
ChEMBL	CHEMBL472749
IUPHAR	N/A
BindingDB	50248337
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
91999	C-X-C chemokine receptor type 1	P25024	CXCR1	Homo sapiens (Human)	350
91998	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360

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