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Name | Adpbetas |
---|---|
Molecular formula | C10H15N5O9P2S |
IUPAC name | [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydroxyphosphinothioyl hydrogen phosphate |
Molecular weight | 443.264 |
Hydrogen bond acceptor | 14 |
Hydrogen bond donor | 6 |
XlogP | -2.9 |
Synonyms | SCHEMBL3096785 35094-45-2 (Parent) 73536-95-5 ADP beta S beta-Thio-ADP [ Show all ] |
Inchi Key | HCIKUKNAJRJFOW-KQYNXXCUSA-N |
Inchi ID | InChI=1S/C10H15N5O9P2S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(23-10)1-22-25(18,19)24-26(20,21)27/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H2,11,12,13)(H2,20,21,27)/t4-,6-,7-,10-/m1/s1 |
PubChem CID | 5310996 |
ChEMBL | CHEMBL335206 |
IUPHAR | 1755 |
BindingDB | 50118230 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
111327 | P2Y purinoceptor 1 | P47900 | P2RY1 | Homo sapiens (Human) | 373 |
111330 | P2Y purinoceptor 1 | P49652 | P2RY1 | Meleagris gallopavo (Wild turkey) | 362 |
111326 | P2Y purinoceptor 11 | Q96G91 | P2RY11 | Homo sapiens (Human) | 374 |
111331 | P2Y purinoceptor 12 | Q9EPX4 | P2ry12 | Rattus norvegicus (Rat) | 343 |
553804 | P2Y purinoceptor 12 | Q9H244 | P2RY12 | Homo sapiens (Human) | 342 |
553805 | P2Y purinoceptor 13 | Q9BPV8 | P2RY13 | Homo sapiens (Human) | 354 |
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