N-[(Z)-(2,6-difluorophenyl)methylideneamino]pyridin-2-amine
Formula:C12H9N3F2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2,6-difluorophenyl)methylideneamino]pyridin-2-amine is a drug-like molecule.
| MolName | N-[(Z)-(2,6-difluorophenyl)methylideneamino]pyridin-2-amine |
| MolecularFormula | C12H9N3F2 |
| Smiles | Fc1cccc(F)c1/C=N\Nc1ncccc1 |
| InChI | InChI=1S/C12H9F2N3/c13-10-4-3-5-11(14)9(10)8-16-17-12-6-1-2-7-15-12/h1-8H,(H,15,17) |
| InChIK | MREPABCFVPWLHL-UHFFFAOYSA-N |
| TotalMolweight | 233.22 |
| Molweight | 233.22 |
| MonoisotopicMass | 233.076453 |
| CLogP | 4.393 |
| CLogS | -3.507 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 180.7 |
| Relative PSA | 0.18783 |
| PolarSurfaceArea | 37.28 |
| Druglikeness | 1.0825 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | 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 | 12 |
| Symmetricatoms | 3 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - N-[(Z)-(2,6-difluorophenyl)methylideneamino]pyridin-2-amine | 2 - N-[(Z)-(2,6-difluorophenyl)methylideneamino]pyridin-2-amine
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