(Z)-N-phenylmethoxy-1-pyridin-4-ylmethanimine
Formula:C13H12N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-N-phenylmethoxy-1-pyridin-4-ylmethanimine is a drug-like molecule.
| MolName | (Z)-N-phenylmethoxy-1-pyridin-4-ylmethanimine |
| MolecularFormula | C13H12N2O |
| Smiles | C(c1ccccc1)O/N=C\c1ccncc1 |
| InChI | InChI=1S/C13H12N2O/c1-2-4-13(5-3-1)11-16-15-10-12-6-8-14-9-7-12/h1-10H,11H2 |
| InChIK | DUCOZYAQYJSURU-UHFFFAOYSA-N |
| TotalMolweight | 212.251 |
| Molweight | 212.251 |
| MonoisotopicMass | 212.094963 |
| CLogP | 2.8348 |
| CLogS | -2.847 |
| H Acceptors | 3 |
| TotalSurfaceArea | 180.3 |
| Relative PSA | 0.18014 |
| PolarSurfaceArea | 34.48 |
| Druglikeness | 0.031126 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.75 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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