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Name | CHEMBL1230331 |
---|---|
Molecular formula | C9H13N2O8PS |
IUPAC name | [(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate |
Molecular weight | 340.243 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 5 |
XlogP | -3.0 |
Synonyms | 4-THIOURIDINE-5''-MONOPHOSPHATE 1-(5-O-Phosphono-beta-D-ribofuranosyl)-4-thioxo-3,4-dihydropyrimidin-2(1H)-one 4145-46-4 UD29 4-Thiouridine 5'-phosphoric acid [ Show all ] |
Inchi Key | CKTAUHRBDDXUDJ-XVFCMESISA-N |
Inchi ID | InChI=1S/C9H13N2O8PS/c12-6-4(3-18-20(15,16)17)19-8(7(6)13)11-2-1-5(21)10-9(11)14/h1-2,4,6-8,12-13H,3H2,(H,10,14,21)(H2,15,16,17)/t4-,6-,7-,8-/m1/s1 |
PubChem CID | 16655024 |
ChEMBL | CHEMBL1230331 |
IUPHAR | N/A |
BindingDB | 50341895 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
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44383 | P2Y purinoceptor 2 | P41231 | P2RY2 | Homo sapiens (Human) | 377 |
44384 | P2Y purinoceptor 4 | P51582 | P2RY4 | Homo sapiens (Human) | 365 |
44382 | P2Y purinoceptor 6 | Q15077 | P2RY6 | Homo sapiens (Human) | 328 |
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