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Ligand

NameCHEMBL328016
Molecular formulaC34H52NO6P
IUPAC name[(2S)-2-[[(Z)-octadec-9-enoyl]amino]-3-(4-phenylmethoxyphenyl)propyl] dihydrogen phosphate
Molecular weight601.765
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP8.7
SynonymsBDBM50146231
Phosphoric acid mono-[(S)-3-(4-benzyloxy-phenyl)-2-((Z)-octadec-9-enoylamino)-propyl] ester
SCHEMBL13109871
VPC12249
Inchi KeyNJLPYJKKKSBCSK-WDCKUFQWSA-N
Inchi IDInChI=1S/C34H52NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-34(36)35-32(29-41-42(37,38)39)27-30-23-25-33(26-24-30)40-28-31-20-17-16-18-21-31/h9-10,16-18,20-21,23-26,32H,2-8,11-15,19,22,27-29H2,1H3,(H,35,36)(H2,37,38,39)/b10-9-/t32-/m0/s1
PubChem CID9960370
ChEMBLCHEMBL328016
IUPHARN/A
BindingDB50146231
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
224898Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
490813Lysophosphatidic acid receptor 1P61793Lpar1Mus musculus (Mouse)364
224897Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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