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Ligand

NameCHEMBL1767419
Molecular formulaC12H19N2O8PS
IUPAC name[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-oxo-2-propylsulfanylpyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate
Molecular weight382.324
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP-1.0
SynonymsBDBM50341890
2-Propylthio-1-beta-D-ribofuranosylpyrimidine-4-one-5''-monophosphate
Inchi KeyFENPKUDFWRAYIO-QCNRFFRDSA-N
Inchi IDInChI=1S/C12H19N2O8PS/c1-2-5-24-12-13-8(15)3-4-14(12)11-10(17)9(16)7(22-11)6-21-23(18,19)20/h3-4,7,9-11,16-17H,2,5-6H2,1H3,(H2,18,19,20)/t7-,9-,10-,11-/m1/s1
PubChem CID52952396
ChEMBLCHEMBL1767419
IUPHARN/A
BindingDB50341890
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
76440P2Y purinoceptor 2P41231P2RY2Homo sapiens (Human)377
76441P2Y purinoceptor 4P51582P2RY4Homo sapiens (Human)365
76439P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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