| MolName | 4-amino-N'-[(4-chlorophenyl)methoxy]-1,2,5-oxadiazole-3-carboximidamide |
| MolecularFormula | C10H10N5O2Cl |
| Smiles | N/C(/c1nonc1N)=N\OCc(cc1)ccc1Cl |
| InChI | InChI=1S/C10H10ClN5O2/c11-7-3-1-6(2-4-7)5-17-15-9(12)8-10(13)16-18-14-8/h1-4H,5H2,(H2,12,15)(H2,13,16) |
| InChIK | BPXWDQNTUWEZLX-UHFFFAOYSA-N |
| TotalMolweight | 267.675 |
| Molweight | 267.675 |
| MonoisotopicMass | 267.052302 |
| CLogP | 1.8351 |
| CLogS | -3.011 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 199.42 |
| Relative PSA | 0.44178 |
| PolarSurfaceArea | 112.55 |
| Druglikeness | 0.93577 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - 4-amino-N'-[(4-chlorophenyl)methoxy]-1,2,5-oxadiazole-3-carboximidamide | 2 - 4-amino-N'-[(4-chlorophenyl)methoxy]-1,2,5-oxadiazole-3-carboximidamide