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Ligand

NameCHEMBL1813122
Molecular formulaC28H25FN2O5
IUPAC name2-[1-[2-fluoro-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]-2-methylindol-3-yl]acetic acid
Molecular weight488.515
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.1
SynonymsBDBM50350371
SCHEMBL5642741
Inchi KeyISOIWEXRGUWTEX-IBGZPJMESA-N
Inchi IDInChI=1S/C28H25FN2O5/c1-17-22(14-27(32)33)20-7-3-4-8-24(20)31(17)28(34)21-12-11-18(13-23(21)29)35-16-19-15-30(2)25-9-5-6-10-26(25)36-19/h3-13,19H,14-16H2,1-2H3,(H,32,33)/t19-/m0/s1
PubChem CID56681885
ChEMBLCHEMBL1813122
IUPHARN/A
BindingDB50350371
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
140874Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
140875Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357

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