2,4-bis[(E)-2-phenylethenyl]pyridine
Formula:C21H17N
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2,4-bis[(E)-2-phenylethenyl]pyridine is not a drug-like molecule.
| MolName | 2,4-bis[(E)-2-phenylethenyl]pyridine |
| MolecularFormula | C21H17N |
| Smiles | C(c1ccccc1)=C/c1cc(/C=C/c2ccccc2)ncc1 |
| InChI | InChI=1S/C21H17N/c1-3-7-18(8-4-1)11-12-20-15-16-22-21(17-20)14-13-19-9-5-2-6-10-19/h1-17H |
| InChIK | XLHNFKOFFFAZAW-UHFFFAOYSA-N |
| TotalMolweight | 283.373 |
| Molweight | 283.373 |
| MonoisotopicMass | 283.136099 |
| CLogP | 5.1267 |
| CLogS | -5.117 |
| H Acceptors | 1 |
| TotalSurfaceArea | 244.54 |
| Relative PSA | 0.04486 |
| PolarSurfaceArea | 12.89 |
| Druglikeness | -1.4269 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.68182 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - 2,4-bis[(E)-2-phenylethenyl]pyridine | 2 - 2,4-bis[(E)-2-phenylethenyl]pyridine
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off