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Name | CHEMBL1784892 |
---|---|
Molecular formula | C16H22N3O15P3 |
IUPAC name | [[(2R,3S,4R,5R)-3,4-dihydroxy-5-[2-oxo-4-(phenylmethoxyamino)pyrimidin-1-yl]oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate |
Molecular weight | 589.279 |
Hydrogen bond acceptor | 15 |
Hydrogen bond donor | 7 |
XlogP | -3.7 |
Synonyms | N4-Benzyloxycytidine-5''-triphosphate BDBM50345484 N-Benzyloxycytidine 5'-triphosphoric acid |
Inchi Key | BQIJGMRNEJCCQG-NMFUWQPSSA-N |
Inchi ID | InChI=1S/C16H22N3O15P3/c20-13-11(9-31-36(26,27)34-37(28,29)33-35(23,24)25)32-15(14(13)21)19-7-6-12(17-16(19)22)18-30-8-10-4-2-1-3-5-10/h1-7,11,13-15,20-21H,8-9H2,(H,26,27)(H,28,29)(H,17,18,22)(H2,23,24,25)/t11-,13-,14-,15-/m1/s1 |
PubChem CID | 53308272 |
ChEMBL | CHEMBL1784892 |
IUPHAR | N/A |
BindingDB | 50345484 |
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. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
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30315 | P2Y purinoceptor 2 | P41231 | P2RY2 | Homo sapiens (Human) | 377 |
30316 | P2Y purinoceptor 4 | P51582 | P2RY4 | Homo sapiens (Human) | 365 |
30314 | P2Y purinoceptor 6 | Q15077 | P2RY6 | Homo sapiens (Human) | 328 |
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