(1Z)-N-(4-fluoroanilino)-2-oxo-2-phenylethanimidoyl cyanide
Formula:C15H10N3OF
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(1Z)-N-(4-fluoroanilino)-2-oxo-2-phenylethanimidoyl cyanide is a drug-like molecule.
| MolName | (1Z)-N-(4-fluoroanilino)-2-oxo-2-phenylethanimidoyl cyanide |
| MolecularFormula | C15H10N3OF |
| Smiles | N#C/C(/C(c1ccccc1)=O)=N/Nc(cc1)ccc1F |
| InChI | InChI=1S/C15H10FN3O/c16-12-6-8-13(9-7-12)18-19-14(10-17)15(20)11-4-2-1-3-5-11/h1-9,18H |
| InChIK | BNBQJIJARROBBZ-UHFFFAOYSA-N |
| TotalMolweight | 267.262 |
| Molweight | 267.262 |
| MonoisotopicMass | 267.08079 |
| CLogP | 3.5266 |
| CLogS | -3.893 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 213.26 |
| Relative PSA | 0.23244 |
| PolarSurfaceArea | 65.25 |
| Druglikeness | -3.3039 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 4 |
| StereoCon |
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