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Ligand

NameCHEMBL183143
Molecular formulaC35H55N2O7P
IUPAC name[(2R)-3-[4-[(4-ethoxypyridin-2-yl)methoxy]phenyl]-2-[[(Z)-octadec-9-enoyl]amino]propyl] dihydrogen phosphate
Molecular weight646.806
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP8.0
SynonymsBDBM50149996
Phosphoric acid mono-[3-[4-(4-ethoxy-pyridin-2-ylmethoxy)-phenyl]-2-((Z)-(R)-octadec-9-enoylamino)-propyl] ester
Inchi KeyHVANCKKENVXQOH-KTLPGOAZSA-N
Inchi IDInChI=1S/C35H55N2O7P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-35(38)37-32(29-44-45(39,40)41)26-30-20-22-33(23-21-30)43-28-31-27-34(42-4-2)24-25-36-31/h11-12,20-25,27,32H,3-10,13-19,26,28-29H2,1-2H3,(H,37,38)(H2,39,40,41)/b12-11-/t32-/m1/s1
PubChem CID44392792
ChEMBLCHEMBL183143
IUPHARN/A
BindingDB50149996
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
124787Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
124786Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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