(E)-4,6-diphenyl-N-pyridin-2-ylpyran-2-imine
Formula:C22H16N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-4,6-diphenyl-N-pyridin-2-ylpyran-2-imine is a drug-like molecule.
| MolName | (E)-4,6-diphenyl-N-pyridin-2-ylpyran-2-imine |
| MolecularFormula | C22H16N2O |
| Smiles | c(cc1)ccc1C(C=C(c1ccccc1)O1)=C/C1=N\c1ncccc1 |
| InChI | InChI=1S/C22H16N2O/c1-3-9-17(10-4-1)19-15-20(18-11-5-2-6-12-18)25-22(16-19)24-21-13-7-8-14-23-21/h1-16H |
| InChIK | JSBLISPRUXDZFI-UHFFFAOYSA-N |
| TotalMolweight | 324.382 |
| Molweight | 324.382 |
| MonoisotopicMass | 324.126263 |
| CLogP | 3.7888 |
| CLogS | -4.23 |
| H Acceptors | 3 |
| TotalSurfaceArea | 260.43 |
| Relative PSA | 0.12472 |
| PolarSurfaceArea | 34.48 |
| Druglikeness | -0.050196 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.48 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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