N'-hydroxy-6-(trifluoromethyl)pyridine-3-carboximidamide
Formula:C7H6N3OF3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-hydroxy-6-(trifluoromethyl)pyridine-3-carboximidamide is a drug-like molecule.
| MolName | N'-hydroxy-6-(trifluoromethyl)pyridine-3-carboximidamide |
| MolecularFormula | C7H6N3OF3 |
| Smiles | N/C(/c1cnc(C(F)(F)F)cc1)=N/O |
| InChI | InChI=1S/C7H6F3N3O/c8-7(9,10)5-2-1-4(3-12-5)6(11)13-14/h1-3,14H,(H2,11,13) |
| InChIK | VGHPKSQSZUDQBX-UHFFFAOYSA-N |
| TotalMolweight | 205.139 |
| Molweight | 205.139 |
| MonoisotopicMass | 205.046296 |
| CLogP | 1.2697 |
| CLogS | -2.087 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 139.32 |
| Relative PSA | 0.36499 |
| PolarSurfaceArea | 71.5 |
| Druglikeness | -8.8548 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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