N'-[(E)-2-(2-hydroxyphenyl)ethenyl]furan-2-carbohydrazide
Formula:C13H12N2O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-[(E)-2-(2-hydroxyphenyl)ethenyl]furan-2-carbohydrazide is a drug-like molecule.
| MolName | N'-[(E)-2-(2-hydroxyphenyl)ethenyl]furan-2-carbohydrazide |
| MolecularFormula | C13H12N2O3 |
| Smiles | Oc1c(/C=C/NNC(c2ccco2)=O)cccc1 |
| InChI | InChI=1S/C13H12N2O3/c16-11-5-2-1-4-10(11)7-8-14-15-13(17)12-6-3-9-18-12/h1-9,14,16H,(H,15,17) |
| InChIK | FJAQZJVXIPLBEQ-UHFFFAOYSA-N |
| TotalMolweight | 244.249 |
| Molweight | 244.249 |
| MonoisotopicMass | 244.084793 |
| CLogP | 0.6908 |
| CLogS | -3.266 |
| H Acceptors | 5 |
| H Donors | 3 |
| TotalSurfaceArea | 196.23 |
| Relative PSA | 0.32192 |
| PolarSurfaceArea | 74.5 |
| Druglikeness | 2.0351 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 2 |
| StereoCon |
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