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Ligand

NameCHEMBL56787
Molecular formulaC10H15N5O7P2S2
IUPAC name9-[4-dihydroxyphosphinothioyloxy-5-(dihydroxyphosphinothioyloxymethyl)oxolan-2-yl]purin-6-amine
Molecular weight443.326
Hydrogen bond acceptor13
Hydrogen bond donor5
XlogP0.3
SynonymsBDBM50062284
Thiophosphoric acid 5-(6-amino-purin-9-yl)-2-thiophosphonooxymethyl-tetrahydro-furan-3-yl ester
Inchi KeyIZRCOAPVMYNKSK-UHFFFAOYSA-N
Inchi IDInChI=1S/C10H15N5O7P2S2/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(22-24(18,19)26)6(21-7)2-20-23(16,17)25/h3-7H,1-2H2,(H2,11,12,13)(H2,16,17,25)(H2,18,19,26)
PubChem CID44299180
ChEMBLN/A
IUPHARN/A
BindingDB50062284
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
520313P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362

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