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Ligand

NameCHEMBL3577177
Molecular formulaC22H36NO9P
IUPAC name(2S)-2-amino-3-[3-[3-(2-heptoxyphenyl)propanoyloxy]propoxy-hydroxyphosphoryl]oxypropanoic acid
Molecular weight489.502
Hydrogen bond acceptor10
Hydrogen bond donor3
XlogP0.4
SynonymsBDBM50096444
Inchi KeyFMJWNEQNALGMKR-IBGZPJMESA-N
Inchi IDInChI=1S/C22H36NO9P/c1-2-3-4-5-8-14-29-20-11-7-6-10-18(20)12-13-21(24)30-15-9-16-31-33(27,28)32-17-19(23)22(25)26/h6-7,10-11,19H,2-5,8-9,12-17,23H2,1H3,(H,25,26)(H,27,28)/t19-/m0/s1
PubChem CID122177523
ChEMBLCHEMBL3577177
IUPHARN/A
BindingDB50096444
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
473007Probable G-protein coupled receptor 174Q9BXC1GPR174Homo sapiens (Human)333
473006Probable G-protein coupled receptor 34Q9UPC5GPR34Homo sapiens (Human)381
473005Putative P2Y purinoceptor 10O00398P2RY10Homo sapiens (Human)339

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