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Name | CHEMBL584184 |
---|---|
Molecular formula | C9H17N2O11P3 |
IUPAC name | 5-(2,4-dioxopyrimidin-1-yl)pentyl-[hydroxy(phosphonooxy)phosphoryl]oxyphosphinic acid |
Molecular weight | 422.159 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 5 |
XlogP | -3.7 |
Synonyms | BDBM50378133 SCHEMBL624295 |
Inchi Key | KIDOXWQUUCRMFM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C9H17N2O11P3/c12-8-4-6-11(9(13)10-8)5-2-1-3-7-23(14,15)21-25(19,20)22-24(16,17)18/h4,6H,1-3,5,7H2,(H,14,15)(H,19,20)(H,10,12,13)(H2,16,17,18) |
PubChem CID | 45481635 |
ChEMBL | CHEMBL584184 |
IUPHAR | N/A |
BindingDB | 50378133 |
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 |
---|---|---|---|---|---|
169727 | P2Y purinoceptor 2 | P35383 | P2ry2 | Mus musculus (Mouse) | 373 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417