N'-anilino-2-phenyl-N-phenyliminoethanimidamide
Formula:C20H18N4
Mutagenic:low
Tumorigenic:high
Reproductive Effective:low
N'-anilino-2-phenyl-N-phenyliminoethanimidamide is not a drug-like molecule.
| MolName | N'-anilino-2-phenyl-N-phenyliminoethanimidamide |
| MolecularFormula | C20H18N4 |
| Smiles | C(/C(/N=N/c1ccccc1)=N\Nc1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C20H18N4/c1-4-10-17(11-5-1)16-20(23-21-18-12-6-2-7-13-18)24-22-19-14-8-3-9-15-19/h1-15,21H,16H2/b23-20?,24-22+ |
| InChIK | BNNOJXRUNSUHFM-LUWDILHYSA-N |
| TotalMolweight | 314.391 |
| Molweight | 314.391 |
| MonoisotopicMass | 314.153146 |
| CLogP | 6.5532 |
| CLogS | -4.923 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 263.99 |
| Relative PSA | 0.17421 |
| PolarSurfaceArea | 49.11 |
| Druglikeness | -3.109 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | low |
| Irritant | low |
| Nasty Functions | azo |
| Shape Index | 0.54167 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 6 |
| StereoCon |
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