(E)-3-(furan-2-yl)-N-(3-sulfamoylphenyl)prop-2-enamide
Formula:C13H12N2O4S
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
(E)-3-(furan-2-yl)-N-(3-sulfamoylphenyl)prop-2-enamide is a drug-like molecule.
| MolName | (E)-3-(furan-2-yl)-N-(3-sulfamoylphenyl)prop-2-enamide |
| MolecularFormula | C13H12N2O4S |
| Smiles | NS(c1cc(NC(/C=C/c2ccco2)=O)ccc1)(=O)=O |
| InChI | InChI=1S/C13H12N2O4S/c14-20(17,18)12-5-1-3-10(9-12)15-13(16)7-6-11-4-2-8-19-11/h1-9H,(H,15,16)(H2,14,17,18) |
| InChIK | SYPBFXBBNJBYOL-UHFFFAOYSA-N |
| TotalMolweight | 292.314 |
| Molweight | 292.314 |
| MonoisotopicMass | 292.051778 |
| CLogP | 1.089 |
| CLogS | -3.079 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 215.52 |
| Relative PSA | 0.38261 |
| PolarSurfaceArea | 110.78 |
| Druglikeness | -3.8682 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| Symmetricatoms | 1 |
| Amides | 2 |
| StereoCon |
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