| MolName | 1-[(3R,5S)-5-(azidomethyl)-5-(hydroxymethyl)oxolan-3-yl]pyrimidine-2,4-dione |
| MolecularFormula | C10H13N5O4 |
| Smiles | [N-]=[N+]=NC[C@](CO)(C1)OC[C@@H]1N(C=CC(N1)=O)C1=O |
| InChI | InChI=1S/C10H13N5O4/c11-14-12-5-10(6-16)3-7(4-19-10)15-2-1-8(17)13-9(15)18/h1-2,7,16H,3-6H2,(H,13,17,18)/t7-,10+/m1/s1 |
| InChIK | YEAYEKFZKCRYOS-XCBNKYQSSA-N |
| TotalMolweight | 267.244 |
| Molweight | 267.244 |
| MonoisotopicMass | 267.096755 |
| CLogP | -1.7378 |
| CLogS | -1.109 |
| H Acceptors | 9 |
| H Donors | 2 |
| TotalSurfaceArea | 195.2 |
| Relative PSA | 0.52039 |
| PolarSurfaceArea | 104.83 |
| Druglikeness | -3.2036 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| StereoCenters | 2 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Sp3Atoms | 8 |
| Amides | 2 |
| StereoCon | this enantiomer |
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1 - 1-[(3R,5S)-5-(azidomethyl)-5-(hydroxymethyl)oxolan-3-yl]pyrimidine-2,4-dione | 2 - 1-[(3R,5S)-5-(azidomethyl)-5-(hydroxymethyl)oxolan-3-yl]pyrimidine-2,4-dione