N'-hydroxy-2-(trifluoromethyl)benzenecarboximidamide
Formula:C8H7N2OF3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-hydroxy-2-(trifluoromethyl)benzenecarboximidamide is a drug-like molecule.
| MolName | N'-hydroxy-2-(trifluoromethyl)benzenecarboximidamide |
| MolecularFormula | C8H7N2OF3 |
| Smiles | N/C(/c1c(C(F)(F)F)cccc1)=N/O |
| InChI | InChI=1S/C8H7F3N2O/c9-8(10,11)6-4-2-1-3-5(6)7(12)13-14/h1-4,14H,(H2,12,13) |
| InChIK | PVKWCVFBDWTUAU-UHFFFAOYSA-N |
| TotalMolweight | 204.151 |
| Molweight | 204.151 |
| MonoisotopicMass | 204.051047 |
| CLogP | 2.2166 |
| CLogS | -2.858 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 140.56 |
| Relative PSA | 0.28372 |
| PolarSurfaceArea | 58.61 |
| Druglikeness | -8.8548 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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