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Ligand

NameCHEMBL42554
Molecular formulaC11H17N5O9P2
IUPAC name[5-(6-aminopurin-9-yl)-3-phosphonooxyoxolan-2-yl]methoxymethylphosphonic acid
Molecular weight425.231
Hydrogen bond acceptor13
Hydrogen bond donor5
XlogP-3.2
Synonyms[5-(6-Amino-purin-9-yl)-3-phosphonooxy-tetrahydro-furan-2-ylmethoxymethyl]-phosphonic acid
BDBM50076457
Inchi KeyGIIWFVBWXMGZIX-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H17N5O9P2/c12-10-9-11(14-3-13-10)16(4-15-9)8-1-6(25-27(20,21)22)7(24-8)2-23-5-26(17,18)19/h3-4,6-8H,1-2,5H2,(H2,12,13,14)(H2,17,18,19)(H2,20,21,22)
PubChem CID44289637
ChEMBLN/A
IUPHARN/A
BindingDB50076457
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
560325P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362

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