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Ligand

NameCHEMBL119382
Molecular formulaC18H30N5O3P
IUPAC name3-[[4-(2-heptyltetrazol-5-yl)phenyl]methylamino]propylphosphonic acid
Molecular weight395.444
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP0.2
SynonymsBDBM50148436
{3-[4-(2-Heptyl-2H-tetrazol-5-yl)-benzylamino]-propyl}-phosphonic acid
Inchi KeyJNAQEIPNFVZKSC-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H30N5O3P/c1-2-3-4-5-6-13-23-21-18(20-22-23)17-10-8-16(9-11-17)15-19-12-7-14-27(24,25)26/h8-11,19H,2-7,12-15H2,1H3,(H2,24,25,26)
PubChem CID44344298
ChEMBLCHEMBL119382
IUPHARN/A
BindingDB50148436
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
154929Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351
154927Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
154928Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353
154926Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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