N'-[(Z)-prop-2-enylideneamino]oxamide
Formula:C5H7N3O2
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
N'-[(Z)-prop-2-enylideneamino]oxamide is a drug-like molecule.
| MolName | N'-[(Z)-prop-2-enylideneamino]oxamide |
| MolecularFormula | C5H7N3O2 |
| Smiles | C=C/C=N\NC(C(N)=O)=O |
| InChI | InChI=1S/C5H7N3O2/c1-2-3-7-8-5(10)4(6)9/h2-3H,1H2,(H2,6,9)(H,8,10) |
| InChIK | GJXOZRPFWBSBTB-UHFFFAOYSA-N |
| TotalMolweight | 141.13 |
| Molweight | 141.13 |
| MonoisotopicMass | 141.053827 |
| CLogP | -1.4021 |
| CLogS | -1.063 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 118.28 |
| Relative PSA | 0.54379 |
| PolarSurfaceArea | 84.55 |
| Druglikeness | -0.43939 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.8 |
| Fragments | 1 |
| Non HAtoms | 10 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Amides | 1 |
| StereoCon |
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