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Ligand

NameSCHEMBL3309912
Molecular formulaC22H24FNO3
IUPAC name5-fluoro-2-[[3-methyl-2-(2-methylpropyl)benzoyl]amino]-1,3-dihydroindene-2-carboxylic acid
Molecular weight369.436
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.7
SynonymsCHEMBL3717871
5-Fluoro-2-(2-isobutyl-3-methyl-benzoylamino)-indan-2-carboxylic acid
MSOVLVYBZYSIEE-UHFFFAOYSA-N
Inchi KeyMSOVLVYBZYSIEE-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H24FNO3/c1-13(2)9-19-14(3)5-4-6-18(19)20(25)24-22(21(26)27)11-15-7-8-17(23)10-16(15)12-22/h4-8,10,13H,9,11-12H2,1-3H3,(H,24,25)(H,26,27)
PubChem CID25160669
ChEMBLCHEMBL3717871
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
527626C-X-C chemokine receptor type 5P32302CXCR5Homo sapiens (Human)372

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