N-[(Z)-1-hydrazinyl-2-nitroethenyl]aniline
Formula:C8H10N4O2
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-1-hydrazinyl-2-nitroethenyl]aniline is a drug-like molecule.
| MolName | N-[(Z)-1-hydrazinyl-2-nitroethenyl]aniline |
| MolecularFormula | C8H10N4O2 |
| Smiles | NN/C(/Nc1ccccc1)=C\[N+]([O-])=O |
| InChI | InChI=1S/C8H10N4O2/c9-11-8(6-12(13)14)10-7-4-2-1-3-5-7/h1-6,10-11H,9H2 |
| InChIK | JQUNGESKERUBCQ-UHFFFAOYSA-N |
| TotalMolweight | 194.193 |
| Molweight | 194.193 |
| MonoisotopicMass | 194.080376 |
| CLogP | -1.2181 |
| CLogS | -3.916 |
| H Acceptors | 6 |
| H Donors | 3 |
| TotalSurfaceArea | 153.08 |
| Relative PSA | 0.4482 |
| PolarSurfaceArea | 95.9 |
| Druglikeness | -8.7087 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | hydrazine |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| AcidicOxygens | 1 |
| StereoCon |
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