6-(4-chlorophenoxy)-N'-hydroxypyridine-3-carboximidamide
Formula:C12H10N3O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
6-(4-chlorophenoxy)-N'-hydroxypyridine-3-carboximidamide is a drug-like molecule.
| MolName | 6-(4-chlorophenoxy)-N'-hydroxypyridine-3-carboximidamide |
| MolecularFormula | C12H10N3O2Cl |
| Smiles | N/C(/c(cc1)cnc1Oc(cc1)ccc1Cl)=N/O |
| InChI | InChI=1S/C12H10ClN3O2/c13-9-2-4-10(5-3-9)18-11-6-1-8(7-15-11)12(14)16-17/h1-7,17H,(H2,14,16) |
| InChIK | MXUPIOFDBWOEBV-UHFFFAOYSA-N |
| TotalMolweight | 263.683 |
| Molweight | 263.683 |
| MonoisotopicMass | 263.046154 |
| CLogP | 2.7204 |
| CLogS | -4.843 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 195.04 |
| Relative PSA | 0.31199 |
| PolarSurfaceArea | 80.73 |
| Druglikeness | -1.4352 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.72222 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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