Thymidine
Representations & DB's id
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ChEBI: | CHEBI:17748 | |
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ChEMBL: | CHEMBL52609 | |
PubChem: | 5789 | |
IUPAC: | 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione | |
Standard InChI: | InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7+,8+/m0/s1 | |
Standard InChI Key: | IQFYYKKMVGJFEH-XLPZGREQSA-N | |
SMILES: | OC[C@H]1O[C@H](C[C@@H]1O)n1cc(C)c(nc1=O)O |
Molecular propeties
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AlogP: | -1.51 | |
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Hydrogen bonds acceptors: | 6 | |
Hydrogen bonds donors: | 3 | |
Rotatable bonds: | 2 | |
Number of rings: | 2 | |
Molecular Weight: | 242.09 | |
Topological polar surface area: | 99.1 | |
Number of aromatic rings: | 1 | |
Fsp3: | 0.6 | |
Number of carbons: | 10 |