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Ligand

Namesphingosylphosphorylcholine
Molecular formulaC23H49N2O5P
IUPAC name[(E,2S,3R)-2-amino-3-hydroxyoctadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular weight464.628
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.7
SynonymsGTPL4032
Lysosphingomyelin
Sphingenyl-1-phosphorylcholine
Sphingosylphosphorylcholine, >=98%, powder
(2S,3R,4E)-2-Amino-4-octadecene-3-hydroxy-1-phosphocholine
[ Show all ]
Inchi KeyJLVSPVFPBBFMBE-HXSWCURESA-N
Inchi IDInChI=1S/C23H49N2O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(26)22(24)21-30-31(27,28)29-20-19-25(2,3)4/h17-18,22-23,26H,5-16,19-21,24H2,1-4H3/b18-17+/t22-,23+/m0/s1
PubChem CID9847290
ChEMBLN/A
IUPHAR4032
BindingDBN/A
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
554037G-protein coupled receptor 12P47775GPR12Homo sapiens (Human)334

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