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Ligand

NameCHEMBL484295
Molecular formulaC10H17N4O15P3
IUPAC name[[(2R,3S,4R,5R)-4-(carbamoylamino)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular weight526.18
Hydrogen bond acceptor15
Hydrogen bond donor8
XlogP-6.4
SynonymsBDBM50271222
({[({[(2R,3S,4R,5R)-4-(carbamoylamino)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
Inchi KeyFJFHGGAQNNVYRH-XVFCMESISA-N
Inchi IDInChI=1S/C10H17N4O15P3/c11-9(17)13-6-7(16)4(27-8(6)14-2-1-5(15)12-10(14)18)3-26-31(22,23)29-32(24,25)28-30(19,20)21/h1-2,4,6-8,16H,3H2,(H,22,23)(H,24,25)(H3,11,13,17)(H,12,15,18)(H2,19,20,21)/t4-,6-,7-,8-/m1/s1
PubChem CID44586005
ChEMBLCHEMBL484295
IUPHARN/A
BindingDB50271222
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
79698P2Y purinoceptor 2P41231P2RY2Homo sapiens (Human)377
79696P2Y purinoceptor 4P51582P2RY4Homo sapiens (Human)365
79697P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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