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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP TM-fold DECOYS POTENTIAL RW/RWplus HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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Ligand

NameCHEMBL383362
Molecular formulaC21H36O6P-
IUPAC name[2-[(9E,12E,15E)-heptadeca-9,12,15-trienyl]-1,3-dioxolan-4-yl]methyl hydrogen phosphate
Molecular weight415.487
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.7
SynonymsBDBM50177338
potassium (2-(heptadeca-9,12,15-trienyl)-1,3-dioxolan-4-yl)methyl hydrogenphosphate
Inchi KeyDXOPTPZUSBDQEI-QMDLBSTFSA-M
Inchi IDInChI=1S/C21H37O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-18-20(27-21)19-26-28(22,23)24/h2-3,5-6,8-9,20-21H,4,7,10-19H2,1H3,(H2,22,23,24)/p-1/b3-2+,6-5+,9-8+
PubChem CID91936394
ChEMBLN/A
IUPHARN/A
BindingDB50177338
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
71483Lysophosphatidic acid receptor 1P61794Lpar1Rattus norvegicus (Rat)364
71481Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351
71482Lysophosphatidic acid receptor 3Q8K5E0Lpar3Rattus norvegicus (Rat)354

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