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Ligand

NameCHEMBL3814356
Molecular formulaC31H36NO11P
IUPAC name(2S)-2-amino-3-[hydroxy-[[(2R,3R)-3-[3-[4-[(3-phenoxyphenyl)methoxy]phenyl]propanoyloxy]oxan-2-yl]methoxy]phosphoryl]oxypropanoic acid
Molecular weight629.599
Hydrogen bond acceptor12
Hydrogen bond donor3
XlogP0.6
SynonymsBDBM50177136
Inchi KeyYMCSKCJNRCSFCQ-ZGIBFIJWSA-N
Inchi IDInChI=1S/C31H36NO11P/c32-27(31(34)35)20-40-44(36,37)41-21-29-28(10-5-17-38-29)43-30(33)16-13-22-11-14-24(15-12-22)39-19-23-6-4-9-26(18-23)42-25-7-2-1-3-8-25/h1-4,6-9,11-12,14-15,18,27-29H,5,10,13,16-17,19-21,32H2,(H,34,35)(H,36,37)/t27-,28+,29+/m0/s1
PubChem CID127050880
ChEMBLCHEMBL3814356
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
533230Probable G-protein coupled receptor 34Q9R1K6Gpr34Mus musculus (Mouse)375
533231Putative P2Y purinoceptor 10Q8BFU7P2ry10Mus musculus (Mouse)328

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