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Ligand

NameCHEMBL432028
Molecular formulaC11H19N5O8P2
IUPAC name[4-[6-(methylamino)purin-9-yl]-2-(phosphonooxymethyl)butyl] dihydrogen phosphate
Molecular weight411.248
Hydrogen bond acceptor12
Hydrogen bond donor5
XlogP-2.4
SynonymsBDBM50085328
Phosphoric acid mono-[4-(6-methylamino-purin-9-yl)-2-phosphonooxymethyl-butyl] ester
288318-05-8
Inchi KeyAUZJPSRVAZOKSZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H19N5O8P2/c1-12-10-9-11(14-6-13-10)16(7-15-9)3-2-8(4-23-25(17,18)19)5-24-26(20,21)22/h6-8H,2-5H2,1H3,(H,12,13,14)(H2,17,18,19)(H2,20,21,22)
PubChem CID10319421
ChEMBLCHEMBL432028
IUPHARN/A
BindingDB50085328
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
15080P2Y purinoceptor 1P49652P2RY1Meleagris gallopavo (Wild turkey)362

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