(2Z)-2-(phenylhydrazinylidene)acenaphthylen-1-one
Formula:C18H12N2O
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
(2Z)-2-(phenylhydrazinylidene)acenaphthylen-1-one is not a drug-like molecule.
| MolName | (2Z)-2-(phenylhydrazinylidene)acenaphthylen-1-one |
| MolecularFormula | C18H12N2O |
| Smiles | O=C(c1cccc2cccc3c12)/C3=N\Nc1ccccc1 |
| InChI | InChI=1S/C18H12N2O/c21-18-15-11-5-7-12-6-4-10-14(16(12)15)17(18)20-19-13-8-2-1-3-9-13/h1-11,19H |
| InChIK | HCOFEPAPGOGFNM-UHFFFAOYSA-N |
| TotalMolweight | 272.306 |
| Molweight | 272.306 |
| MonoisotopicMass | 272.094963 |
| CLogP | 5.4732 |
| CLogS | -5.345 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 206.3 |
| Relative PSA | 0.17455 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 2.2903 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52381 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 2 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Symmetricatoms | 2 |
| StereoCon |
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