N-[(Z)-(3-fluorophenyl)methylideneamino]-2,6-diphenylpyrimidin-4-amine
Formula:C23H17N4F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(3-fluorophenyl)methylideneamino]-2,6-diphenylpyrimidin-4-amine is not a drug-like molecule.
| MolName | N-[(Z)-(3-fluorophenyl)methylideneamino]-2,6-diphenylpyrimidin-4-amine |
| MolecularFormula | C23H17N4F |
| Smiles | Fc1cc(/C=N\Nc2nc(-c3ccccc3)nc(-c3ccccc3)c2)ccc1 |
| InChI | InChI=1S/C23H17FN4/c24-20-13-7-8-17(14-20)16-25-28-22-15-21(18-9-3-1-4-10-18)26-23(27-22)19-11-5-2-6-12-19/h1-16H,(H,26,27,28) |
| InChIK | BZJBHNDEROHVMG-UHFFFAOYSA-N |
| TotalMolweight | 368.414 |
| Molweight | 368.414 |
| MonoisotopicMass | 368.143724 |
| CLogP | 7.1231 |
| CLogS | -6.907 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 292.63 |
| Relative PSA | 0.15347 |
| PolarSurfaceArea | 50.17 |
| Druglikeness | 1.0825 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - N-[(Z)-(3-fluorophenyl)methylideneamino]-2,6-diphenylpyrimidin-4-amine | 2 - N-[(Z)-(3-fluorophenyl)methylideneamino]-2,6-diphenylpyrimidin-4-amine
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