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Ligand

NameCHEMBL328474
Molecular formulaC30H48NO6P
IUPAC name[(2S)-2-[[(Z)-octadec-9-enoyl]amino]-3-(4-prop-2-ynoxyphenyl)propyl] dihydrogen phosphate
Molecular weight549.689
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP7.3
SynonymsBDBM50146249
Phosphoric acid mono-[(S)-2-((Z)-octadec-9-enoylamino)-3-(4-prop-2-ynyloxy-phenyl)-propyl] ester
Inchi KeyDYEIZFCEKFBLDA-BMMGBYBSSA-N
Inchi IDInChI=1S/C30H48NO6P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(32)31-28(26-37-38(33,34)35)25-27-20-22-29(23-21-27)36-24-4-2/h2,11-12,20-23,28H,3,5-10,13-19,24-26H2,1H3,(H,31,32)(H2,33,34,35)/b12-11-/t28-/m0/s1
PubChem CID11512311
ChEMBLCHEMBL328474
IUPHARN/A
BindingDB50146249
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
71929Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
71930Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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