N-[(Z)-(4-fluorophenyl)methylideneamino]-5-phenyl-1,3-thiazol-2-amine
Formula:C16H12N3FS
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-(4-fluorophenyl)methylideneamino]-5-phenyl-1,3-thiazol-2-amine is not a drug-like molecule.
| MolName | N-[(Z)-(4-fluorophenyl)methylideneamino]-5-phenyl-1,3-thiazol-2-amine |
| MolecularFormula | C16H12N3FS |
| Smiles | Fc1ccc(/C=N\Nc2ncc(-c3ccccc3)s2)cc1 |
| InChI | InChI=1S/C16H12FN3S/c17-14-8-6-12(7-9-14)10-19-20-16-18-11-15(21-16)13-4-2-1-3-5-13/h1-11H,(H,18,20) |
| InChIK | MLHTZEZTSIITAF-UHFFFAOYSA-N |
| TotalMolweight | 297.356 |
| Molweight | 297.356 |
| MonoisotopicMass | 297.073595 |
| CLogP | 6.4653 |
| CLogS | -5.303 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 230.05 |
| Relative PSA | 0.23604 |
| PolarSurfaceArea | 65.52 |
| Druglikeness | 2.1593 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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