N'-hydroxy-2-(3-oxo-1H-isoindol-2-yl)ethanimidamide
Formula:C10H11N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-hydroxy-2-(3-oxo-1H-isoindol-2-yl)ethanimidamide is a drug-like molecule.
| MolName | N'-hydroxy-2-(3-oxo-1H-isoindol-2-yl)ethanimidamide |
| MolecularFormula | C10H11N3O2 |
| Smiles | N/C(/CN(Cc1c2cccc1)C2=O)=N/O |
| InChI | InChI=1S/C10H11N3O2/c11-9(12-15)6-13-5-7-3-1-2-4-8(7)10(13)14/h1-4,15H,5-6H2,(H2,11,12) |
| InChIK | RRERQTPQWFMJSD-UHFFFAOYSA-N |
| TotalMolweight | 205.216 |
| Molweight | 205.216 |
| MonoisotopicMass | 205.085127 |
| CLogP | 0.1768 |
| CLogS | -1.722 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 153.17 |
| Relative PSA | 0.36868 |
| PolarSurfaceArea | 78.92 |
| Druglikeness | 3.4643 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 15 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 3 |
| Amides | 1 |
| StereoCon |
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