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Ligand

NameCHEMBL3577176
Molecular formulaC30H52NO10P
IUPAC name(2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-[3-(4-pentadecoxyphenyl)propanoyloxy]propoxy]phosphoryl]oxypropanoic acid
Molecular weight617.717
Hydrogen bond acceptor11
Hydrogen bond donor4
XlogP3.7
SynonymsBDBM50096443
Inchi KeyIBNSOXBZKPVHNZ-IAPPQJPRSA-N
Inchi IDInChI=1S/C30H52NO10P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-38-27-18-15-25(16-19-27)17-20-29(33)39-22-26(32)23-40-42(36,37)41-24-28(31)30(34)35/h15-16,18-19,26,28,32H,2-14,17,20-24,31H2,1H3,(H,34,35)(H,36,37)/t26-,28+/m1/s1
PubChem CID122177522
ChEMBLCHEMBL3577176
IUPHARN/A
BindingDB50096443
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
478844Probable G-protein coupled receptor 174Q9BXC1GPR174Homo sapiens (Human)333
478843Probable G-protein coupled receptor 34Q9UPC5GPR34Homo sapiens (Human)381
478842Putative P2Y purinoceptor 10O00398P2RY10Homo sapiens (Human)339

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