5-(2-fluorophenyl)-N-[4-[(E)-2-phenylethenyl]phenyl]furan-2-carboxamide
Formula:C25H18NO2F
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
5-(2-fluorophenyl)-N-[4-[(E)-2-phenylethenyl]phenyl]furan-2-carboxamide is not a drug-like molecule.
| MolName | 5-(2-fluorophenyl)-N-[4-[(E)-2-phenylethenyl]phenyl]furan-2-carboxamide |
| MolecularFormula | C25H18NO2F |
| Smiles | O=C(c1ccc(-c(cccc2)c2F)o1)Nc1ccc(/C=C/c2ccccc2)cc1 |
| InChI | InChI=1S/C25H18FNO2/c26-22-9-5-4-8-21(22)23-16-17-24(29-23)25(28)27-20-14-12-19(13-15-20)11-10-18-6-2-1-3-7-18/h1-17H,(H,27,28) |
| InChIK | ASLYVBHLYZNEEU-UHFFFAOYSA-N |
| TotalMolweight | 383.421 |
| Molweight | 383.421 |
| MonoisotopicMass | 383.132157 |
| CLogP | 6.0538 |
| CLogS | -7.038 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 304.29 |
| Relative PSA | 0.12689 |
| PolarSurfaceArea | 42.24 |
| Druglikeness | 1.3117 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.65517 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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