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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	CHEMBL254981
Molecular formula	C24H23F4N3O4
IUPAC name	3-[[2-[[(1R)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-methylpropyl]amino]-3,4-dioxocyclobuten-1-yl]amino]-2-hydroxy-N,N-dimethylbenzamide
Molecular weight	493.459
Hydrogen bond acceptor	10
Hydrogen bond donor	3
XlogP	5.0
Synonyms	BDBM50236054 (R)-3-(2-(1-(3-fluoro-5-(trifluoromethyl)phenyl)-2-methylpropylamino)-3,4-dioxocyclobut-1-enylamino)-2-hydroxy-N,N-dimethylbenzamide
Inchi Key	ALECVXATYUKGSG-QGZVFWFLSA-N
Inchi ID	InChI=1S/C24H23F4N3O4/c1-11(2)17(12-8-13(24(26,27)28)10-14(25)9-12)30-19-18(21(33)22(19)34)29-16-7-5-6-15(20(16)32)23(35)31(3)4/h5-11,17,29-30,32H,1-4H3/t17-/m1/s1
PubChem CID	44447963
ChEMBL	CHEMBL254981
IUPHAR	N/A
BindingDB	50236054
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
8169	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360

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