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Ligand

NameFingolimod phosphate
Molecular formulaC19H34NO5P
IUPAC name[2-amino-2-(hydroxymethyl)-4-(4-octylphenyl)butyl] dihydrogen phosphate
Molecular weight387.457
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP0.8
SynonymsPhosphoric acid mono-[2-amino-2-hydroxymethyl-4-(4-octyl-phenyl)-butyl] ester
402616-23-3
D06DYN
FTY720 (R)-Phosphate
FTY720-phosphate
[ Show all ]
Inchi KeyLRFKWQGGENFBFO-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H34NO5P/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-25-26(22,23)24/h9-12,21H,2-8,13-16,20H2,1H3,(H2,22,23,24)
PubChem CID9908268
ChEMBLCHEMBL114606
IUPHAR2924
BindingDB23163
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
194460Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
554274Sphingosine 1-phosphate receptor 1O08530S1pr1Mus musculus (Mouse)382
194459Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353
194461Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378
194458Sphingosine 1-phosphate receptor 4O95977S1PR4Homo sapiens (Human)384
554275Sphingosine 1-phosphate receptor 4Q9Z0L1S1pr4Mus musculus (Mouse)386
194457Sphingosine 1-phosphate receptor 5Q9H228S1PR5Homo sapiens (Human)398

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