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Ligand

NameCHEMBL1915671
Molecular formulaC27H28N2O5
IUPAC name2-[3-[[2,5-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
SynonymsBDBM50357623
SCHEMBL730691
Inchi KeyKDQQDGQGYXWECN-NRFANRHFSA-N
Inchi IDInChI=1S/C27H28N2O5/c1-17-12-25(33-16-21-15-29(3)23-9-4-5-10-24(23)34-21)18(2)11-22(17)27(32)28-20-8-6-7-19(13-20)14-26(30)31/h4-13,21H,14-16H2,1-3H3,(H,28,32)(H,30,31)/t21-/m0/s1
PubChem CID11259714
ChEMBLCHEMBL1915671
IUPHARN/A
BindingDB50357623
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
166615Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
166616Prostaglandin D2 receptorP70263PtgdrMus musculus (Mouse)357

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