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Ligand

NameCHEMBL92452
Molecular formulaC24H34NO6P
IUPAC name[2-(octanoylamino)-3-(4-phenylmethoxyphenyl)propyl] dihydrogen phosphate
Molecular weight463.511
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP4.2
SynonymsBDBM50146228
Phosphoric acid mono-[3-(4-benzyloxy-phenyl)-2-octanoylamino-propyl] ester
Inchi KeyKVCPOUHIDCPFLV-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H34NO6P/c1-2-3-4-5-9-12-24(26)25-22(19-31-32(27,28)29)17-20-13-15-23(16-14-20)30-18-21-10-7-6-8-11-21/h6-8,10-11,13-16,22H,2-5,9,12,17-19H2,1H3,(H,25,26)(H2,27,28,29)
PubChem CID44325214
ChEMBLCHEMBL92452
IUPHARN/A
BindingDB50146228
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
179006Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
179007Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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