4-(2-phenylphenoxy)butanimidamide
Formula:C16H18N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-(2-phenylphenoxy)butanimidamide is a drug-like molecule.
| MolName | 4-(2-phenylphenoxy)butanimidamide |
| MolecularFormula | C16H18N2O |
| Smiles | NC(CCCOc(cccc1)c1-c1ccccc1)=N |
| InChI | InChI=1S/C16H18N2O/c17-16(18)11-6-12-19-15-10-5-4-9-14(15)13-7-2-1-3-8-13/h1-5,7-10H,6,11-12H2,(H3,17,18) |
| InChIK | AZFZAEBJIXXMAZ-UHFFFAOYSA-N |
| TotalMolweight | 254.332 |
| Molweight | 254.332 |
| MonoisotopicMass | 254.141913 |
| CLogP | 2.4908 |
| CLogS | -3.291 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 213.13 |
| Relative PSA | 0.19176 |
| PolarSurfaceArea | 59.1 |
| Druglikeness | -5.541 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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