2-[(E)-2-(2-chloro-6-fluorophenyl)ethenyl]quinoxaline
Formula:C16H10N2ClF
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(E)-2-(2-chloro-6-fluorophenyl)ethenyl]quinoxaline is a drug-like molecule.
| MolName | 2-[(E)-2-(2-chloro-6-fluorophenyl)ethenyl]quinoxaline |
| MolecularFormula | C16H10N2ClF |
| Smiles | Fc1cccc(Cl)c1/C=C/c1nc2ccccc2nc1 |
| InChI | InChI=1S/C16H10ClFN2/c17-13-4-3-5-14(18)12(13)9-8-11-10-19-15-6-1-2-7-16(15)20-11/h1-10H |
| InChIK | CXHPHRDFVBQLLC-UHFFFAOYSA-N |
| TotalMolweight | 284.72 |
| Molweight | 284.72 |
| MonoisotopicMass | 284.051653 |
| CLogP | 4.065 |
| CLogS | -4.632 |
| H Acceptors | 2 |
| TotalSurfaceArea | 213.41 |
| Relative PSA | 0.10281 |
| PolarSurfaceArea | 25.78 |
| Druglikeness | -2.6315 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - 2-[(E)-2-(2-chloro-6-fluorophenyl)ethenyl]quinoxaline | 2 - 2-[(E)-2-(2-chloro-6-fluorophenyl)ethenyl]quinoxaline
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