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Ligand

NameCHEMBL416252
Molecular formulaC11H17N5O9P2
IUPAC name[5-(6-aminopurin-9-yl)-2-(phosphonooxymethyl)oxan-3-yl] dihydrogen phosphate
Molecular weight425.231
Hydrogen bond acceptor13
Hydrogen bond donor5
XlogP-3.8
SynonymsPhosphoric acid mono-[5-(6-amino-purin-9-yl)-2-phosphonooxymethyl-tetrahydro-pyran-3-yl] ester
BDBM50076474
Inchi KeyATUACDJWYMPIOV-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H17N5O9P2/c12-10-9-11(14-4-13-10)16(5-15-9)6-1-7(25-27(20,21)22)8(23-2-6)3-24-26(17,18)19/h4-8H,1-3H2,(H2,12,13,14)(H2,17,18,19)(H2,20,21,22)
PubChem CID44288784
ChEMBLN/A
IUPHARN/A
BindingDB50076474
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
14334P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362

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