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Ligand

NameCHEMBL360064
Molecular formulaC32H51N2O5P
IUPAC name[(3S)-3-(hexadecanoylamino)-4-[4-(pyridin-2-ylmethoxy)phenyl]butyl]phosphonic acid
Molecular weight574.743
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP7.9
SynonymsBDBM50150004
{(S)-3-Hexadecanoylamino-4-[4-(pyridin-2-ylmethoxy)-phenyl]-butyl}-phosphonic acid
Inchi KeyDEJKWCWVWGRHDH-GDLZYMKVSA-N
Inchi IDInChI=1S/C32H51N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-32(35)34-29(23-25-40(36,37)38)26-28-19-21-31(22-20-28)39-27-30-17-15-16-24-33-30/h15-17,19-22,24,29H,2-14,18,23,25-27H2,1H3,(H,34,35)(H2,36,37,38)/t29-/m1/s1
PubChem CID44392834
ChEMBLCHEMBL360064
IUPHARN/A
BindingDB50150004
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
57809Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
57810Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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