2,4,5-trifluoro-N'-hydroxybenzenecarboximidamide
Formula:C7H5N2OF3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2,4,5-trifluoro-N'-hydroxybenzenecarboximidamide is a drug-like molecule.
| MolName | 2,4,5-trifluoro-N'-hydroxybenzenecarboximidamide |
| MolecularFormula | C7H5N2OF3 |
| Smiles | N/C(/c(c(F)c1)cc(F)c1F)=N/O |
| InChI | InChI=1S/C7H5F3N2O/c8-4-2-6(10)5(9)1-3(4)7(11)12-13/h1-2,13H,(H2,11,12) |
| InChIK | JWJFTTGUXZRMMI-UHFFFAOYSA-N |
| TotalMolweight | 190.124 |
| Molweight | 190.124 |
| MonoisotopicMass | 190.035397 |
| CLogP | 1.6707 |
| CLogS | -3.022 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 130.15 |
| Relative PSA | 0.30642 |
| PolarSurfaceArea | 58.61 |
| Druglikeness | -3.0048 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | polyhalo aromatic ring |
| Shape Index | 0.61538 |
| Fragments | 1 |
| Non HAtoms | 13 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| StereoCon |
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