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Ligand

NameCHEMBL500840
Molecular formulaC16H28N2O22P4
IUPAC name[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [[[(2S,3R,4R,5S)-5-ethyl-3,4,5-trihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl] hydrogen phosphate
Molecular weight724.287
Hydrogen bond acceptor22
Hydrogen bond donor10
XlogP-8.1
SynonymsBDBM50270544
Uridine-5''-fructose-6''-tetraphosphate
Inchi KeyIRHOAYPWMKMNPQ-MLTZJJJHSA-N
Inchi IDInChI=1S/C16H28N2O22P4/c1-2-16(25)13(23)11(21)8(37-16)6-35-42(28,29)39-44(32,33)40-43(30,31)38-41(26,27)34-5-7-10(20)12(22)14(36-7)18-4-3-9(19)17-15(18)24/h3-4,7-8,10-14,20-23,25H,2,5-6H2,1H3,(H,26,27)(H,28,29)(H,30,31)(H,32,33)(H,17,19,24)/t7-,8+,10-,11+,12-,13-,14-,16+/m1/s1
PubChem CID44585517
ChEMBLCHEMBL500840
IUPHARN/A
BindingDB50270544
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
139971P2Y purinoceptor 2P41231P2RY2Homo sapiens (Human)377
139972P2Y purinoceptor 4P51582P2RY4Homo sapiens (Human)365
139970P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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