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Name | CHEMBL572655 |
---|---|
Molecular formula | C8H15N2O12P3 |
IUPAC name | [4-(2,4-dioxopyrimidin-1-yl)butoxy-hydroxyphosphoryl] phosphono hydrogen phosphate |
Molecular weight | 424.131 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 5 |
XlogP | -4.0 |
Synonyms | BDBM50378125 |
Inchi Key | CYMANVSFIMYRNA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C8H15N2O12P3/c11-7-3-5-10(8(12)9-7)4-1-2-6-20-24(16,17)22-25(18,19)21-23(13,14)15/h3,5H,1-2,4,6H2,(H,16,17)(H,18,19)(H,9,11,12)(H2,13,14,15) |
PubChem CID | 45481782 |
ChEMBL | CHEMBL572655 |
IUPHAR | N/A |
BindingDB | 50378125 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
53657 | P2Y purinoceptor 2 | P35383 | P2ry2 | Mus musculus (Mouse) | 373 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417