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Ligand

NameCHEMBL117529
Molecular formulaC21H40NO5P
IUPAC name3-[[(Z)-octadec-9-enoyl]amino]propanoylphosphonic acid
Molecular weight417.527
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP4.9
SynonymsSCHEMBL13110057
BDBM50148351
[3-((Z)-Octadec-9-enoylamino)-propionyl]-phosphonic acid
Inchi KeyBXBZKTOVFLATAM-KTKRTIGZSA-N
Inchi IDInChI=1S/C21H40NO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)22-19-18-21(24)28(25,26)27/h9-10H,2-8,11-19H2,1H3,(H,22,23)(H2,25,26,27)/b10-9-
PubChem CID10136738
ChEMBLCHEMBL117529
IUPHARN/A
BindingDB50148351
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34951Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
34949Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351
34950Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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