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Ligand

NameCHEMBL94011
Molecular formulaC28H48NO6P
IUPAC name[(2R)-3-(4-methoxyphenyl)-2-[[(Z)-octadec-9-enoyl]amino]propyl] dihydrogen phosphate
Molecular weight525.667
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP7.2
SynonymsBDBM50146253
Phosphoric acid mono-[(R)-3-(4-methoxy-phenyl)-2-((Z)-octadec-9-enoylamino)-propyl] ester
Inchi KeyHZKLUBCHTUBBKC-ZXAYODBVSA-N
Inchi IDInChI=1S/C28H48NO6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28(30)29-26(24-35-36(31,32)33)23-25-19-21-27(34-2)22-20-25/h10-11,19-22,26H,3-9,12-18,23-24H2,1-2H3,(H,29,30)(H2,31,32,33)/b11-10-/t26-/m1/s1
PubChem CID44325339
ChEMBLCHEMBL94011
IUPHARN/A
BindingDB50146253
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
127779Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
127778Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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