N'-hydroxy-2-naphthalen-1-ylethanimidamide
Formula:C12H12N2O
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
N'-hydroxy-2-naphthalen-1-ylethanimidamide is a drug-like molecule.
| MolName | N'-hydroxy-2-naphthalen-1-ylethanimidamide |
| MolecularFormula | C12H12N2O |
| Smiles | N/C(/Cc1cccc2ccccc12)=N/O |
| InChI | InChI=1S/C12H12N2O/c13-12(14-15)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7,15H,8H2,(H2,13,14) |
| InChIK | NWWCOKUDFCFADE-UHFFFAOYSA-N |
| TotalMolweight | 200.24 |
| Molweight | 200.24 |
| MonoisotopicMass | 200.094963 |
| CLogP | 2.5608 |
| CLogS | -3.651 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 159.46 |
| Relative PSA | 0.25009 |
| PolarSurfaceArea | 58.61 |
| Druglikeness | -1.7097 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 15 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Sp3Atoms | 2 |
| StereoCon |
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