N-phenyl-N-[(E)-2-phenylethenyl]hydroxylamine
Formula:C14H13NO
Mutagenic:low
Tumorigenic:low
Reproductive Effective:none
N-phenyl-N-[(E)-2-phenylethenyl]hydroxylamine is a drug-like molecule.
| MolName | N-phenyl-N-[(E)-2-phenylethenyl]hydroxylamine |
| MolecularFormula | C14H13NO |
| Smiles | ON(/C=C/c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C14H13NO/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12,16H |
| InChIK | GVOKLKZQHPLSAN-UHFFFAOYSA-N |
| TotalMolweight | 211.263 |
| Molweight | 211.263 |
| MonoisotopicMass | 211.099714 |
| CLogP | 2.7131 |
| CLogS | -3.184 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 176.17 |
| Relative PSA | 0.094511 |
| PolarSurfaceArea | 23.47 |
| Druglikeness | -0.8694 |
| Mutagenic | low |
| Tumorigenic | low |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6875 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| StereoCon |
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