nitro(pyridin-2-yl)azanide
Formula:C5H4N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
nitro(pyridin-2-yl)azanide is a drug-like molecule.
| MolName | nitro(pyridin-2-yl)azanide |
| MolecularFormula | C5H4N3O2 |
| Smiles | [O-][N+]([N-]c1ncccc1)=O |
| InChI | InChI=1S/C5H4N3O2/c9-8(10)7-5-3-1-2-4-6-5/h1-4H/q-1 |
| InChIK | BVPJQGNCMRSQLF-UHFFFAOYSA-N |
| TotalMolweight | 138.106 |
| Molweight | 138.106 |
| MonoisotopicMass | 138.030352 |
| CLogP | 0.9482 |
| CLogS | -1.672 |
| H Acceptors | 5 |
| TotalSurfaceArea | 95.69 |
| Relative PSA | 0.43254 |
| PolarSurfaceArea | 58.71 |
| Druglikeness | -4.1953 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 10 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| AcidicOxygens | 1 |
| StereoCon |
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