(E)-3-(2,4-dichlorophenyl)prop-2-enehydrazide
Formula:C9H8N2OCl2
Mutagenic:none
Tumorigenic:high
Reproductive Effective:low
(E)-3-(2,4-dichlorophenyl)prop-2-enehydrazide is a drug-like molecule.
| MolName | (E)-3-(2,4-dichlorophenyl)prop-2-enehydrazide |
| MolecularFormula | C9H8N2OCl2 |
| Smiles | NNC(/C=C/c(ccc(Cl)c1)c1Cl)=O |
| InChI | InChI=1S/C9H8Cl2N2O/c10-7-3-1-6(8(11)5-7)2-4-9(14)13-12/h1-5H,12H2,(H,13,14) |
| InChIK | WWOAAMJEUHUILM-UHFFFAOYSA-N |
| TotalMolweight | 231.082 |
| Molweight | 231.082 |
| MonoisotopicMass | 230.001367 |
| CLogP | 1.524 |
| CLogS | -3.824 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 168.33 |
| Relative PSA | 0.23626 |
| PolarSurfaceArea | 55.12 |
| Druglikeness | -6.635 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | hydrazine |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| StereoCon |
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