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Ligand

NameCHEMBL1813124
Molecular formulaC28H25ClN2O5
IUPAC name2-[1-[3-chloro-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]-2-methylindol-3-yl]acetic acid
Molecular weight504.967
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.6
SynonymsSCHEMBL5644559
BDBM50350373
Inchi KeySNSGVPMIGUZIHF-IBGZPJMESA-N
Inchi IDInChI=1S/C28H25ClN2O5/c1-17-21(14-27(32)33)20-7-3-4-8-23(20)31(17)28(34)18-11-12-25(22(29)13-18)35-16-19-15-30(2)24-9-5-6-10-26(24)36-19/h3-13,19H,14-16H2,1-2H3,(H,32,33)/t19-/m0/s1
PubChem CID56675229
ChEMBLCHEMBL1813124
IUPHARN/A
BindingDB50350373
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
318805Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
318804Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357

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