(NE)-N-(1-phenyl-2-pyridin-2-ylethylidene)hydroxylamine
Formula:C13H12N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-(1-phenyl-2-pyridin-2-ylethylidene)hydroxylamine is a drug-like molecule.
| MolName | (NE)-N-(1-phenyl-2-pyridin-2-ylethylidene)hydroxylamine |
| MolecularFormula | C13H12N2O |
| Smiles | O/N=C(\Cc1ncccc1)/c1ccccc1 |
| InChI | InChI=1S/C13H12N2O/c16-15-13(11-6-2-1-3-7-11)10-12-8-4-5-9-14-12/h1-9,16H,10H2 |
| InChIK | WRADUEDMKDJYKA-UHFFFAOYSA-N |
| TotalMolweight | 212.251 |
| Molweight | 212.251 |
| MonoisotopicMass | 212.094963 |
| CLogP | 2.6472 |
| CLogS | -3.039 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 174.86 |
| Relative PSA | 0.20348 |
| PolarSurfaceArea | 45.48 |
| Druglikeness | -1.1612 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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