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Ligand

NameCHEMBL1199752
Molecular formulaC9H13FN2O11P2
IUPAC name[(2R,3R,4S,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
Molecular weight406.152
Hydrogen bond acceptor12
Hydrogen bond donor5
XlogP-3.7
SynonymsBDBM50194146
(2R,3S,4R,5R)-1-(5-(diphosphoryloxymethyl)-3-fluoro-4-hydroxytetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione ammonium salt
Inchi KeyGPPKODXOVXLGIG-PXBUCIJWSA-N
Inchi IDInChI=1S/C9H13FN2O11P2/c10-6-7(14)4(3-21-25(19,20)23-24(16,17)18)22-8(6)12-2-1-5(13)11-9(12)15/h1-2,4,6-8,14H,3H2,(H,19,20)(H,11,13,15)(H2,16,17,18)/t4-,6+,7-,8-/m1/s1
PubChem CID16082710
ChEMBLN/A
IUPHARN/A
BindingDB50194146
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
102173P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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