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Name | CHEMBL3634186 |
---|---|
Molecular formula | C10H14ClN5O9P2S |
IUPAC name | [(2R,3S,4R,5R)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydroxyphosphinothioyl hydrogen phosphate |
Molecular weight | 477.706 |
Hydrogen bond acceptor | 14 |
Hydrogen bond donor | 6 |
XlogP | -1.9 |
Synonyms | BDBM50131060 |
Inchi Key | HCAOYDQLBKPHRD-UUOKFMHZSA-N |
Inchi ID | InChI=1S/C10H14ClN5O9P2S/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(18)5(17)3(24-9)1-23-26(19,20)25-27(21,22)28/h2-3,5-6,9,17-18H,1H2,(H,19,20)(H2,12,14,15)(H2,21,22,28)/t3-,5-,6-,9-/m1/s1 |
PubChem CID | 122195895 |
ChEMBL | CHEMBL3634186 |
IUPHAR | N/A |
BindingDB | 50131060 |
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 |
---|---|---|---|---|---|
476599 | P2Y purinoceptor 1 | P47900 | P2RY1 | Homo sapiens (Human) | 373 |
476598 | P2Y purinoceptor 11 | Q96G91 | P2RY11 | Homo sapiens (Human) | 374 |
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