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Ligand

NameCHEMBL1915861
Molecular formulaC27H26Cl2N2O5
IUPAC name2-[4-chloro-3-[[2-chloro-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]amino]phenyl]-2-methylpropanoic acid
Molecular weight529.414
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP6.0
SynonymsBDBM50357633
SCHEMBL732358
Inchi KeyBXYBFNHPEXVZMH-SFHVURJKSA-N
Inchi IDInChI=1S/C27H26Cl2N2O5/c1-27(2,26(33)34)16-8-11-20(28)22(12-16)30-25(32)19-10-9-17(13-21(19)29)35-15-18-14-31(3)23-6-4-5-7-24(23)36-18/h4-13,18H,14-15H2,1-3H3,(H,30,32)(H,33,34)/t18-/m0/s1
PubChem CID57391065
ChEMBLCHEMBL1915861
IUPHARN/A
BindingDB50357633
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
35562Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
35563Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
35564Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357

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