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Ligand

NameCHEMBL220398
Molecular formulaC9H14IN2O15P3
IUPAC name[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular weight610.036
Hydrogen bond acceptor15
Hydrogen bond donor7
XlogP-5.5
Synonyms5-iodouridine triphosphate
ZINC38151347
({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(5-iodo-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
5-Iodouridine 5'-triphosphoric acid
BDBM50205414
[ Show all ]
Inchi KeyABOQIBZHFFLOGM-UAKXSSHOSA-N
Inchi IDInChI=1S/C9H14IN2O15P3/c10-3-1-12(9(16)11-7(3)15)8-6(14)5(13)4(25-8)2-24-29(20,21)27-30(22,23)26-28(17,18)19/h1,4-6,8,13-14H,2H2,(H,20,21)(H,22,23)(H,11,15,16)(H2,17,18,19)/t4-,5-,6-,8-/m1/s1
PubChem CID9830339
ChEMBLCHEMBL220398
IUPHARN/A
BindingDB50205414
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
1037P2Y purinoceptor 2P41231P2RY2Homo sapiens (Human)377

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