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Ligand

NameCHEMBL1813277
Molecular formulaC28H24F2N2O5
IUPAC name2-[5-fluoro-1-[2-fluoro-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]-2-methylindol-3-yl]acetic acid
Molecular weight506.506
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP5.2
SynonymsBDBM50350354
SCHEMBL5646406
Inchi KeyBFWADSJIODONAN-IBGZPJMESA-N
Inchi IDInChI=1S/C28H24F2N2O5/c1-16-21(13-27(33)34)22-11-17(29)7-10-24(22)32(16)28(35)20-9-8-18(12-23(20)30)36-15-19-14-31(2)25-5-3-4-6-26(25)37-19/h3-12,19H,13-15H2,1-2H3,(H,33,34)/t19-/m0/s1
PubChem CID56661509
ChEMBLCHEMBL1813277
IUPHARN/A
BindingDB50350354
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
22692Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
22693Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357

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