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Name | CHEMBL3706409 |
---|---|
Molecular formula | C10H15N5O8P2S |
IUPAC name | [(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-(phosphonooxymethyl)thiolan-3-yl] dihydrogen phosphate |
Molecular weight | 427.265 |
Hydrogen bond acceptor | 13 |
Hydrogen bond donor | 5 |
XlogP | -2.9 |
Synonyms | 9-[[(2R)-4alpha-(Phosphonooxy)-5beta-(phosphonooxymethyl)tetrahydrothiophene]-2beta-yl]-9H-purine-6-amine |
Inchi Key | HEYHWCIASKGSFO-RRKCRQDMSA-N |
Inchi ID | InChI=1S/C10H15N5O8P2S/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(23-25(19,20)21)6(26-7)2-22-24(16,17)18/h3-7H,1-2H2,(H2,11,12,13)(H2,16,17,18)(H2,19,20,21)/t5-,6+,7+/m0/s1 |
PubChem CID | 100966982 |
ChEMBL | CHEMBL3706409 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
476848 | P2Y purinoceptor 1 | P49652 | P2RY1 | Meleagris gallopavo (Wild turkey) | 362 |
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