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Ligand

NameCHEMBL1915672
Molecular formulaC27H28N2O5
IUPAC name2-[3-[[2,6-dimethyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]amino]phenyl]acetic acid
Molecular weight460.53
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.5
SynonymsBDBM50357622
SCHEMBL732882
Inchi KeyBTRINOSIFKLWFT-QFIPXVFZSA-N
Inchi IDInChI=1S/C27H28N2O5/c1-17-11-21(33-16-22-15-29(3)23-9-4-5-10-24(23)34-22)12-18(2)26(17)27(32)28-20-8-6-7-19(13-20)14-25(30)31/h4-13,22H,14-16H2,1-3H3,(H,28,32)(H,30,31)/t22-/m0/s1
PubChem CID11328662
ChEMBLCHEMBL1915672
IUPHARN/A
BindingDB50357622
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
32615Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
32614Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357

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