[(E)-3-oxo-2-phenylprop-1-enyl]urea
Formula:C10H10N2O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(E)-3-oxo-2-phenylprop-1-enyl]urea is a drug-like molecule.
| MolName | [(E)-3-oxo-2-phenylprop-1-enyl]urea |
| MolecularFormula | C10H10N2O2 |
| Smiles | NC(N/C=C(/C=O)\c1ccccc1)=O |
| InChI | InChI=1S/C10H10N2O2/c11-10(14)12-6-9(7-13)8-4-2-1-3-5-8/h1-7H,(H3,11,12,14) |
| InChIK | QWVAYEDULUWVIW-UHFFFAOYSA-N |
| TotalMolweight | 190.201 |
| Molweight | 190.201 |
| MonoisotopicMass | 190.074228 |
| CLogP | -0.1558 |
| CLogS | -2.173 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 155.24 |
| Relative PSA | 0.34018 |
| PolarSurfaceArea | 72.19 |
| Druglikeness | -1.3877 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Symmetricatoms | 2 |
| Amides | 2 |
| StereoCon |
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