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Ligand

NameBDBM50303332
Molecular formulaC12H15N3O12P2-2
IUPAC name[2-cyanoethoxy(oxido)phosphoryl] [(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate
Molecular weight455.209
Hydrogen bond acceptor13
Hydrogen bond donor3
XlogP-4.7
SynonymsDiphosphoric Acid 1-beta-(2-Cyanoethyl)Ester 2-(Uridine-5''-yl)ester, di ammonium Salt
Inchi KeyWDMLAXZJWYFTMB-QCNRFFRDSA-L
Inchi IDInChI=1S/C12H17N3O12P2/c13-3-1-5-24-28(20,21)27-29(22,23)25-6-7-9(17)10(18)11(26-7)15-4-2-8(16)14-12(15)19/h2,4,7,9-11,17-18H,1,5-6H2,(H,20,21)(H,22,23)(H,14,16,19)/p-2/t7-,9-,10-,11-/m1/s1
PubChem CID91933946
ChEMBLN/A
IUPHARN/A
BindingDB50303332
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
370725P2Y purinoceptor 14Q15391P2RY14Homo sapiens (Human)338
370726P2Y purinoceptor 6Q15077P2RY6Homo sapiens (Human)328

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