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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL3577151
Molecular formulaC20H40NO8P
IUPAC name(2S)-2-amino-3-[hydroxy(3-tetradecanoyloxypropoxy)phosphoryl]oxypropanoic acid
Molecular weight453.513
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP1.9
SynonymsBDBM50096357
Inchi KeyPQVATKARQXQHPW-SFHVURJKSA-N
Inchi IDInChI=1S/C20H40NO8P/c1-2-3-4-5-6-7-8-9-10-11-12-14-19(22)27-15-13-16-28-30(25,26)29-17-18(21)20(23)24/h18H,2-17,21H2,1H3,(H,23,24)(H,25,26)/t18-/m0/s1
PubChem CID122177499
ChEMBLCHEMBL3577151
IUPHARN/A
BindingDB50096357
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
495877Probable G-protein coupled receptor 174Q9BXC1GPR174Homo sapiens (Human)333
495876Probable G-protein coupled receptor 34Q9UPC5GPR34Homo sapiens (Human)381
495875Putative P2Y purinoceptor 10O00398P2RY10Homo sapiens (Human)339

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