(E)-3-thiophen-2-ylprop-2-enehydrazide
Formula:C7H8N2OS
Mutagenic:none
Tumorigenic:high
Reproductive Effective:low
(E)-3-thiophen-2-ylprop-2-enehydrazide is a drug-like molecule.
| MolName | (E)-3-thiophen-2-ylprop-2-enehydrazide |
| MolecularFormula | C7H8N2OS |
| Smiles | NNC(/C=C/c1cccs1)=O |
| InChI | InChI=1S/C7H8N2OS/c8-9-7(10)4-3-6-2-1-5-11-6/h1-5H,8H2,(H,9,10) |
| InChIK | JSIIFHBPPQDDGK-UHFFFAOYSA-N |
| TotalMolweight | 168.22 |
| Molweight | 168.22 |
| MonoisotopicMass | 168.035733 |
| CLogP | 0.1786 |
| CLogS | -2.362 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 133.43 |
| Relative PSA | 0.45065 |
| PolarSurfaceArea | 83.36 |
| Druglikeness | -4.4915 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | hydrazine |
| Shape Index | 0.72727 |
| Fragments | 1 |
| Non HAtoms | 11 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 5 |
| Sp3Atoms | 1 |
| StereoCon |
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