| MolName | 4-amino-5-fluoro-1-[(2R,5R)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-one |
| MolecularFormula | C9H10N3O3F |
| Smiles | NC(C(F)=CN1[C@@H]2O[C@@H](CO)C=C2)=NC1=O |
| InChI | InChI=1S/C9H10FN3O3/c10-6-3-13(9(15)12-8(6)11)7-2-1-5(4-14)16-7/h1-3,5,7,14H,4H2,(H2,11,12,15)/t5-,7+/m0/s1 |
| InChIK | HSBKFSPNDWWPSL-CAHLUQPWSA-N |
| TotalMolweight | 227.194 |
| Molweight | 227.194 |
| MonoisotopicMass | 227.07062 |
| CLogP | -1.4045 |
| CLogS | -1.814 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 158.71 |
| Relative PSA | 0.41881 |
| PolarSurfaceArea | 88.15 |
| Druglikeness | -1.1565 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| StereoCenters | 2 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Sp3Atoms | 5 |
| Amides | 1 |
| BasicNitrogens | 1 |
| StereoCon | this enantiomer |
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1 - 4-amino-5-fluoro-1-[(2R,5R)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-one | 2 - 4-amino-5-fluoro-1-[(2R,5R)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-one