3-hydroxy-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]benzamide
Formula:C16H14N2O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
3-hydroxy-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]benzamide is a drug-like molecule.
| MolName | 3-hydroxy-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]benzamide |
| MolecularFormula | C16H14N2O2 |
| Smiles | Oc1cccc(C(N/N=C\C=C\c2ccccc2)=O)c1 |
| InChI | InChI=1S/C16H14N2O2/c19-15-10-4-9-14(12-15)16(20)18-17-11-5-8-13-6-2-1-3-7-13/h1-12,19H,(H,18,20) |
| InChIK | YJSDBNJNXMEBOA-UHFFFAOYSA-N |
| TotalMolweight | 266.299 |
| Molweight | 266.299 |
| MonoisotopicMass | 266.105528 |
| CLogP | 2.8742 |
| CLogS | -3.717 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 219.84 |
| Relative PSA | 0.22339 |
| PolarSurfaceArea | 61.69 |
| Druglikeness | 4.4185 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| 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 | 1 |
| Symmetricatoms | 2 |
| StereoCon |
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