N-[(Z)-3-anilino-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
Formula:C20H16N2O4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
N-[(Z)-3-anilino-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide is a drug-like molecule.
| MolName | N-[(Z)-3-anilino-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide |
| MolecularFormula | C20H16N2O4 |
| Smiles | Oc1ccc(/C=C(/C(Nc2ccccc2)=O)\NC(c2ccco2)=O)cc1 |
| InChI | InChI=1S/C20H16N2O4/c23-16-10-8-14(9-11-16)13-17(22-20(25)18-7-4-12-26-18)19(24)21-15-5-2-1-3-6-15/h1-13,23H,(H,21,24)(H,22,25) |
| InChIK | OYIUCFZOFGUGKT-UHFFFAOYSA-N |
| TotalMolweight | 348.357 |
| Molweight | 348.357 |
| MonoisotopicMass | 348.111008 |
| CLogP | 3.2668 |
| CLogS | -4.259 |
| H Acceptors | 6 |
| H Donors | 3 |
| TotalSurfaceArea | 271.95 |
| Relative PSA | 0.28024 |
| PolarSurfaceArea | 91.57 |
| Druglikeness | 2.8484 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Amides | 2 |
| StereoCon |
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