| MolName | [(2S,4R)-4-(6-aminopurin-9-yl)-2-(azidomethyl)oxolan-2-yl]methanol |
| MolecularFormula | C11H14N8O2 |
| Smiles | Nc1c2ncn([C@H]3CO[C@@](CN=[N+]=[N-])(CO)C3)c2ncn1 |
| InChI | InChI=1S/C11H14N8O2/c12-9-8-10(15-5-14-9)19(6-16-8)7-1-11(4-20,21-2-7)3-17-18-13/h5-7,20H,1-4H2,(H2,12,14,15)/t7-,11-/m0/s1 |
| InChIK | WXMAYUSHHOLDJJ-CPCISQLKSA-N |
| TotalMolweight | 290.286 |
| Molweight | 290.286 |
| MonoisotopicMass | 290.123972 |
| CLogP | -0.8756 |
| CLogS | -1.393 |
| H Acceptors | 10 |
| H Donors | 2 |
| TotalSurfaceArea | 213.3 |
| Relative PSA | 0.54168 |
| PolarSurfaceArea | 125.04 |
| Druglikeness | -7.9012 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| StereoCenters | 2 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 9 |
| Sp3Atoms | 8 |
| Aromatic Nitrogens | 4 |
| BasicNitrogens | 1 |
| StereoCon | this enantiomer |
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1 - [(2S,4R)-4-(6-aminopurin-9-yl)-2-(azidomethyl)oxolan-2-yl]methanol | 2 - [(2S,4R)-4-(6-aminopurin-9-yl)-2-(azidomethyl)oxolan-2-yl]methanol