2-fluoro-N-[(Z)-furan-2-ylmethylideneamino]benzamide
Formula:C12H9N2O2F
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
2-fluoro-N-[(Z)-furan-2-ylmethylideneamino]benzamide is a drug-like molecule.
| MolName | 2-fluoro-N-[(Z)-furan-2-ylmethylideneamino]benzamide |
| MolecularFormula | C12H9N2O2F |
| Smiles | O=C(c(cccc1)c1F)N/N=C\c1ccco1 |
| InChI | InChI=1S/C12H9FN2O2/c13-11-6-2-1-5-10(11)12(16)15-14-8-9-4-3-7-17-9/h1-8H,(H,15,16) |
| InChIK | GTTOCYNTHFWDCA-UHFFFAOYSA-N |
| TotalMolweight | 232.213 |
| Molweight | 232.213 |
| MonoisotopicMass | 232.064806 |
| CLogP | 2.4911 |
| CLogS | -3.717 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 183.03 |
| Relative PSA | 0.27383 |
| PolarSurfaceArea | 54.6 |
| Druglikeness | 2.7954 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.64706 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| StereoCon |
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