(E)-3-(furan-2-yl)-N,N-dipyridin-2-ylprop-2-enamide
Formula:C17H13N3O2
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
(E)-3-(furan-2-yl)-N,N-dipyridin-2-ylprop-2-enamide is a drug-like molecule.
| MolName | (E)-3-(furan-2-yl)-N,N-dipyridin-2-ylprop-2-enamide |
| MolecularFormula | C17H13N3O2 |
| Smiles | O=C(/C=C/c1ccco1)N(c1ncccc1)c1ncccc1 |
| InChI | InChI=1S/C17H13N3O2/c21-17(10-9-14-6-5-13-22-14)20(15-7-1-3-11-18-15)16-8-2-4-12-19-16/h1-13H |
| InChIK | VVZAODPQTBZEMJ-UHFFFAOYSA-N |
| TotalMolweight | 291.309 |
| Molweight | 291.309 |
| MonoisotopicMass | 291.100777 |
| CLogP | 1.9344 |
| CLogS | -4.636 |
| H Acceptors | 5 |
| TotalSurfaceArea | 234.54 |
| Relative PSA | 0.22444 |
| PolarSurfaceArea | 59.23 |
| Druglikeness | 0.35166 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Symmetricatoms | 6 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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