(Z)-2-naphthalen-1-yl-3-pyridin-4-ylprop-2-enamide
Formula:C18H14N2O
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
(Z)-2-naphthalen-1-yl-3-pyridin-4-ylprop-2-enamide is a drug-like molecule.
| MolName | (Z)-2-naphthalen-1-yl-3-pyridin-4-ylprop-2-enamide |
| MolecularFormula | C18H14N2O |
| Smiles | NC(/C(/c1cccc2ccccc12)=C\c1ccncc1)=O |
| InChI | InChI=1S/C18H14N2O/c19-18(21)17(12-13-8-10-20-11-9-13)16-7-3-5-14-4-1-2-6-15(14)16/h1-12H,(H2,19,21) |
| InChIK | OZICVIHHJDBMNI-UHFFFAOYSA-N |
| TotalMolweight | 274.322 |
| Molweight | 274.322 |
| MonoisotopicMass | 274.110613 |
| CLogP | 2.6064 |
| CLogS | -3.843 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 217.36 |
| Relative PSA | 0.18071 |
| PolarSurfaceArea | 55.98 |
| Druglikeness | 1.2602 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52381 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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