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Ligand

NameCHEMBL1915676
Molecular formulaC27H27ClN2O5
IUPAC name2-[4-chloro-3-[[2,3-dimethyl-4-[[(2S)-4-methyl-2,3-dihydro-1,4-benzoxazin-2-yl]methoxy]benzoyl]amino]phenyl]acetic acid
Molecular weight494.972
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP5.2
SynonymsBDBM50357627
SCHEMBL732523
Inchi KeyATEWBGFTNCNDLW-IBGZPJMESA-N
Inchi IDInChI=1S/C27H27ClN2O5/c1-16-17(2)24(34-15-19-14-30(3)23-6-4-5-7-25(23)35-19)11-9-20(16)27(33)29-22-12-18(13-26(31)32)8-10-21(22)28/h4-12,19H,13-15H2,1-3H3,(H,29,33)(H,31,32)/t19-/m0/s1
PubChem CID11352417
ChEMBLCHEMBL1915676
IUPHARN/A
BindingDB50357627
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
13889Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
13888Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357

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