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Ligand

NameCHEMBL117715
Molecular formulaC19H33ClNO5P
IUPAC name3-[(3-chloro-5-methoxy-4-octoxyphenyl)methylamino]propylphosphonic acid
Molecular weight421.899
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP1.5
SynonymsBDBM50148420
SCHEMBL14195697
[3-(3-Chloro-5-methoxy-4-octyloxy-benzylamino)-propyl]-phosphonic acid
Inchi KeyGBAYNJCGVHFQTM-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H33ClNO5P/c1-3-4-5-6-7-8-11-26-19-17(20)13-16(14-18(19)25-2)15-21-10-9-12-27(22,23)24/h13-14,21H,3-12,15H2,1-2H3,(H2,22,23,24)
PubChem CID10173327
ChEMBLCHEMBL117715
IUPHARN/A
BindingDB50148420
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
92112Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351
92113Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
92111Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353
92110Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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