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Name | CHEMBL575257 |
---|---|
Molecular formula | C10H15N5O9P2S |
IUPAC name | [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl] dihydrogen phosphate |
Molecular weight | 443.264 |
Hydrogen bond acceptor | 14 |
Hydrogen bond donor | 6 |
XlogP | -2.9 |
Synonyms | AC1L56SE CHEMBL3934928 Adenosine,-5'-P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) Adpalphas adenosine 5'-(1-thiodiphosphate) [ Show all ] |
Inchi Key | LPUNOWSWFBIBQH-JVXRWYCYSA-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)1-22-26(21,27)24-25(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,27)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-,26?/m1/s1 |
PubChem CID | 171069 |
ChEMBL | CHEMBL575257 |
IUPHAR | N/A |
BindingDB | 50131059 |
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 |
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486848 | P2Y purinoceptor 1 | P47900 | P2RY1 | Homo sapiens (Human) | 373 |
486847 | P2Y purinoceptor 11 | Q96G91 | P2RY11 | Homo sapiens (Human) | 374 |
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