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Ligand

NameCHEMBL1813278
Molecular formulaC29H27FN2O5
IUPAC name2-[5-fluoro-2-methyl-1-[3-methyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]indol-3-yl]acetic acid
Molecular weight502.542
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.5
SynonymsSCHEMBL5646970
BDBM50350355
Inchi KeyCWWPWPJCOKXXSE-NRFANRHFSA-N
Inchi IDInChI=1S/C29H27FN2O5/c1-17-12-19(8-11-26(17)36-16-21-15-31(3)25-6-4-5-7-27(25)37-21)29(35)32-18(2)22(14-28(33)34)23-13-20(30)9-10-24(23)32/h4-13,21H,14-16H2,1-3H3,(H,33,34)/t21-/m0/s1
PubChem CID56668353
ChEMBLCHEMBL1813278
IUPHARN/A
BindingDB50350355
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
52503Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
52502Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357

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