| MolName | (E)-3-naphthalen-1-yl-N-[6-[[(E)-3-naphthalen-1-ylprop-2-enoyl]amino]hexyl]prop-2-enamide |
| MolecularFormula | C32H32N2O2 |
| Smiles | O=C(/C=C/c1cccc2ccccc12)NCCCCCCNC(/C=C/c1cccc2ccccc12)=O |
| InChI | InChI=1S/C32H32N2O2/c35-31(21-19-27-15-9-13-25-11-3-5-17-29(25)27)33-23-7-1-2-8-24-34-32(36)22-20-28-16-10-14-26-12-4-6-18-30(26)28/h3-6,9-22H,1-2,7-8,23-24H2,(H,33,35)(H,34,36) |
| InChIK | ADKNIUMSLRAEFZ-UHFFFAOYSA-N |
| TotalMolweight | 476.618 |
| Molweight | 476.618 |
| MonoisotopicMass | 476.246378 |
| CLogP | 6.897 |
| CLogS | -7.89 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 396.2 |
| Relative PSA | 0.12367 |
| PolarSurfaceArea | 58.2 |
| Druglikeness | -6.2211 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 36 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 11 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 20 |
| Sp3Atoms | 6 |
| Symmetricatoms | 18 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - (E)-3-naphthalen-1-yl-N-[6-[[(E)-3-naphthalen-1-ylprop-2-enoyl]amino]hexyl]prop-2-enamide | 2 - (E)-3-naphthalen-1-yl-N-[6-[[(E)-3-naphthalen-1-ylprop-2-enoyl]amino]hexyl]prop-2-enamide