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Ligand

NameCHEMBL1743884
Molecular formulaC15H24N2O17P2
IUPAC name[[(2R,3S,4R,5S)-5-(2,4-dioxo-1H-pyrimidin-6-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
Molecular weight566.302
Hydrogen bond acceptor17
Hydrogen bond donor10
XlogP-7.1
SynonymsBDBM50370674
USAZACJQJDHAJH-KDEXOMDGSA-N
Inchi KeyUSAZACJQJDHAJH-KDEXOMDGSA-N
Inchi IDInChI=1S/C15H24N2O17P2/c18-2-5-8(20)10(22)12(24)14(32-5)33-36(28,29)34-35(26,27)30-3-6-9(21)11(23)13(31-6)4-1-7(19)17-15(25)16-4/h1,5-6,8-14,18,20-24H,2-3H2,(H,26,27)(H,28,29)(H2,16,17,19,25)/t5-,6-,8+,9-,10+,11-,12-,13+,14-/m1/s1
PubChem CID54584734
ChEMBLCHEMBL1743884
IUPHARN/A
BindingDB50370674
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
344144P2Y purinoceptor 14Q15391P2RY14Homo sapiens (Human)338

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