N'-hydroxy-2,3-dihydro-1-benzofuran-5-carboximidamide
Formula:C9H10N2O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-hydroxy-2,3-dihydro-1-benzofuran-5-carboximidamide is a drug-like molecule.
| MolName | N'-hydroxy-2,3-dihydro-1-benzofuran-5-carboximidamide |
| MolecularFormula | C9H10N2O2 |
| Smiles | N/C(/c(cc1)cc2c1OCC2)=N/O |
| InChI | InChI=1S/C9H10N2O2/c10-9(11-12)7-1-2-8-6(5-7)3-4-13-8/h1-2,5,12H,3-4H2,(H2,10,11) |
| InChIK | KGLRLCNFJVSMCI-UHFFFAOYSA-N |
| TotalMolweight | 178.19 |
| Molweight | 178.19 |
| MonoisotopicMass | 178.074228 |
| CLogP | 1.5941 |
| CLogS | -2.447 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 135.12 |
| Relative PSA | 0.36915 |
| PolarSurfaceArea | 67.84 |
| Druglikeness | -1.8865 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61538 |
| Fragments | 1 |
| Non HAtoms | 13 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 4 |
| StereoCon |
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