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Ligand

NameSCHEMBL3308734
Molecular formulaC23H22FNO3
IUPAC name2-[[2-(cyclopenten-1-yl)-3-methylbenzoyl]amino]-5-fluoro-1,3-dihydroindene-2-carboxylic acid
Molecular weight379.431
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.3
Synonyms2-(2-Cyclopent-1-enyl-3-methyl-benzoylamino)-5-fluoro-indan-2-carboxylic acid
SSCNSRFCMRTGIA-UHFFFAOYSA-N
CHEMBL3718468
Inchi KeySSCNSRFCMRTGIA-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H22FNO3/c1-14-5-4-8-19(20(14)15-6-2-3-7-15)21(26)25-23(22(27)28)12-16-9-10-18(24)11-17(16)13-23/h4-6,8-11H,2-3,7,12-13H2,1H3,(H,25,26)(H,27,28)
PubChem CID25159484
ChEMBLCHEMBL3718468
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
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GLASS IDNameUniProtGeneSpeciesLength
530590C-X-C chemokine receptor type 5P32302CXCR5Homo sapiens (Human)372

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