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Name | pA>p |
---|---|
Molecular formula | C10H13N5O9P2 |
IUPAC name | [(3aR,4R,6R,6aR)-4-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-6-yl]methyl dihydrogen phosphate |
Molecular weight | 409.188 |
Hydrogen bond acceptor | 13 |
Hydrogen bond donor | 4 |
XlogP | -3.7 |
Synonyms | cADP CHEMBL1230695 ADENOSINE-5'-PHOSPHATE-2',3'-CYCLIC PHOSPHATE [(2S,3aR,4R,6R,6aR)-6-(6-amino-9H-purin-9-yl)-2-hydroxy-2-oxidotetrahydrofuro[3,4-d][1,3,2]dioxaphosphol-4-yl]methyl dihydrogen phosphate CHEBI:40403 [ Show all ] |
Inchi Key | HJMBCNJTGVMDOA-KQYNXXCUSA-N |
Inchi ID | InChI=1S/C10H13N5O9P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7-6(23-26(19,20)24-7)4(22-10)1-21-25(16,17)18/h2-4,6-7,10H,1H2,(H,19,20)(H2,11,12,13)(H2,16,17,18)/t4-,6-,7-,10-/m1/s1 |
PubChem CID | 12876352 |
ChEMBL | CHEMBL1230695 |
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 |
---|---|---|---|---|---|
116532 | P2Y purinoceptor 1 | P49652 | P2RY1 | Meleagris gallopavo (Wild turkey) | 362 |
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