(Z)-3-[3-[(Z)-2-cyano-2-pyridin-2-ylethenyl]phenyl]-2-pyridin-2-ylprop-2-enenitrile
Formula:C22H14N4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(Z)-3-[3-[(Z)-2-cyano-2-pyridin-2-ylethenyl]phenyl]-2-pyridin-2-ylprop-2-enenitrile is a drug-like molecule.
| MolName | (Z)-3-[3-[(Z)-2-cyano-2-pyridin-2-ylethenyl]phenyl]-2-pyridin-2-ylprop-2-enenitrile |
| MolecularFormula | C22H14N4 |
| Smiles | N#C/C(/c1ncccc1)=C\c1cccc(/C=C(/c2ncccc2)\C#N)c1 |
| InChI | InChI=1S/C22H14N4/c23-15-19(21-8-1-3-10-25-21)13-17-6-5-7-18(12-17)14-20(16-24)22-9-2-4-11-26-22/h1-14H |
| InChIK | YOXBZWHYDKTNRT-UHFFFAOYSA-N |
| TotalMolweight | 334.381 |
| Molweight | 334.381 |
| MonoisotopicMass | 334.121846 |
| CLogP | 3.1118 |
| CLogS | -4.1 |
| H Acceptors | 4 |
| TotalSurfaceArea | 283.14 |
| Relative PSA | 0.17327 |
| PolarSurfaceArea | 73.36 |
| Druglikeness | -5.0798 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57692 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 12 |
| Aromatic Nitrogens | 2 |
| StereoCon |
Click to Load Molecule:
1 - (Z)-3-[3-[(Z)-2-cyano-2-pyridin-2-ylethenyl]phenyl]-2-pyridin-2-ylprop-2-enenitrile | 2 - (Z)-3-[3-[(Z)-2-cyano-2-pyridin-2-ylethenyl]phenyl]-2-pyridin-2-ylprop-2-enenitrile
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off