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Ligand

NameVPC32183
Molecular formulaC33H51N2O6P
IUPAC name[(2R)-2-[[(Z)-octadec-9-enoyl]amino]-3-[4-(pyridin-3-ylmethoxy)phenyl]propyl] dihydrogen phosphate
Molecular weight602.753
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP7.7
SynonymsBDBM50150002
compound 10t [PMID: 15125924]
Phosphoric acid mono-{(R)-2-((Z)-octadec-9-enoylamino)-3-[4-(pyridin-3-ylmethoxy)-phenyl]-propyl} ester
D0S6CW
CHEMBL184055
[ Show all ]
Inchi KeyKMTDWYLEJRZIJN-HWNQJZBBSA-N
Inchi IDInChI=1S/C33H51N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-33(36)35-31(28-41-42(37,38)39)25-29-20-22-32(23-21-29)40-27-30-18-17-24-34-26-30/h9-10,17-18,20-24,26,31H,2-8,11-16,19,25,27-28H2,1H3,(H,35,36)(H2,37,38,39)/b10-9-/t31-/m1/s1
PubChem CID44392752
ChEMBLCHEMBL184055
IUPHAR2908
BindingDB50150002
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
172975Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
554150Lysophosphatidic acid receptor 1P61793Lpar1Mus musculus (Mouse)364
172974Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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