2-[1-oxo-4-(phenylhydrazinylidene)naphthalen-2-yl]-4-(phenylhydrazinylidene)naphthalen-1-one
Formula:C32H22N4O2
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
2-[1-oxo-4-(phenylhydrazinylidene)naphthalen-2-yl]-4-(phenylhydrazinylidene)naphthalen-1-one is not a drug-like molecule.
| MolName | 2-[1-oxo-4-(phenylhydrazinylidene)naphthalen-2-yl]-4-(phenylhydrazinylidene)naphthalen-1-one |
| MolecularFormula | C32H22N4O2 |
| Smiles | O=C(c1c2cccc1)C(C(C(c1c3cccc1)=O)=CC3=NNc1ccccc1)=CC2=NNc1ccccc1 |
| InChI | InChI=1S/C32H22N4O2/c37-31-25-17-9-7-15-23(25)29(35-33-21-11-3-1-4-12-21)19-27(31)28-20-30(36-34-22-13-5-2-6-14-22)24-16-8-10-18-26(24)32(28)38/h1-20,33-34H |
| InChIK | HIOBKCIORASKEV-UHFFFAOYSA-N |
| TotalMolweight | 494.553 |
| Molweight | 494.553 |
| MonoisotopicMass | 494.174276 |
| CLogP | 9.278 |
| CLogS | -7.366 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 379.32 |
| Relative PSA | 0.18987 |
| PolarSurfaceArea | 82.92 |
| Druglikeness | 2.4 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.47368 |
| Fragments | 1 |
| Non HAtoms | 38 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 6 |
| Small Rings | 6 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Symmetricatoms | 21 |
| StereoCon |
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