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Ligand

NameCHEMBL482505
Molecular formulaC17H33O8P
IUPAC name[(2R)-2-heptanoyloxy-3-phosphonooxypropyl] heptanoate
Molecular weight396.417
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP3.2
Synonyms(2R)-2,3-bis(heptanoyloxy)propoxyphosphonic acid
BDBM50271805
DB08376
(2r)-3-(Phosphonooxy)propane-1,2-Diyl Diheptanoate
Heptanoic acid (R)-1-heptanoyloxymethyl-2-phosphonooxy-ethyl ester
Inchi KeyJAXUAGQDLYDLQB-OAHLLOKOSA-N
Inchi IDInChI=1S/C17H33O8P/c1-3-5-7-9-11-16(18)23-13-15(14-24-26(20,21)22)25-17(19)12-10-8-6-4-2/h15H,3-14H2,1-2H3,(H2,20,21,22)/t15-/m1/s1
PubChem CID23629653
ChEMBLCHEMBL482505
IUPHARN/A
BindingDB50271805
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
146422Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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