(3E)-3-hydrazinylideneinden-1-one
Formula:C9H8N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3E)-3-hydrazinylideneinden-1-one is a drug-like molecule.
| MolName | (3E)-3-hydrazinylideneinden-1-one |
| MolecularFormula | C9H8N2O |
| Smiles | N/N=C(\C1)/c(cccc2)c2C1=O |
| InChI | InChI=1S/C9H8N2O/c10-11-8-5-9(12)7-4-2-1-3-6(7)8/h1-4H,5,10H2 |
| InChIK | QDEDEJDOELHRAJ-UHFFFAOYSA-N |
| TotalMolweight | 160.176 |
| Molweight | 160.176 |
| MonoisotopicMass | 160.063663 |
| CLogP | 1.3467 |
| CLogS | -3.253 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 122.76 |
| Relative PSA | 0.32437 |
| PolarSurfaceArea | 55.45 |
| Druglikeness | -1.9974 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.58333 |
| Fragments | 1 |
| Non HAtoms | 12 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 2 |
| StereoCon |
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