2-chloro-N-hydroxy-N-[4-[(E)-2-phenylethenyl]phenyl]acetamide
Formula:C16H14NO2Cl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:high
2-chloro-N-hydroxy-N-[4-[(E)-2-phenylethenyl]phenyl]acetamide is a drug-like molecule.
| MolName | 2-chloro-N-hydroxy-N-[4-[(E)-2-phenylethenyl]phenyl]acetamide |
| MolecularFormula | C16H14NO2Cl |
| Smiles | ON(C(CCl)=O)c1ccc(/C=C/c2ccccc2)cc1 |
| InChI | InChI=1S/C16H14ClNO2/c17-12-16(19)18(20)15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-11,20H,12H2 |
| InChIK | BYMYTHNIAUASOH-UHFFFAOYSA-N |
| TotalMolweight | 287.745 |
| Molweight | 287.745 |
| MonoisotopicMass | 287.071306 |
| CLogP | 3.4754 |
| CLogS | -3.981 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 223.1 |
| Relative PSA | 0.13308 |
| PolarSurfaceArea | 40.54 |
| Druglikeness | 0.42647 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| StereoCon |
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1 - 2-chloro-N-hydroxy-N-[4-[(E)-2-phenylethenyl]phenyl]acetamide | 2 - 2-chloro-N-hydroxy-N-[4-[(E)-2-phenylethenyl]phenyl]acetamide
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