2-amino-N-[(E)-[2-(benzimidazol-1-yl)-1-phenylethylidene]amino]benzamide
Formula:C22H19N5O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-amino-N-[(E)-[2-(benzimidazol-1-yl)-1-phenylethylidene]amino]benzamide is a drug-like molecule.
| MolName | 2-amino-N-[(E)-[2-(benzimidazol-1-yl)-1-phenylethylidene]amino]benzamide |
| MolecularFormula | C22H19N5O |
| Smiles | Nc(cccc1)c1C(N/N=C(/Cn1c(cccc2)c2nc1)\c1ccccc1)=O |
| InChI | InChI=1S/C22H19N5O/c23-18-11-5-4-10-17(18)22(28)26-25-20(16-8-2-1-3-9-16)14-27-15-24-19-12-6-7-13-21(19)27/h1-13,15H,14,23H2,(H,26,28) |
| InChIK | OYYLLBNIYHVHPR-UHFFFAOYSA-N |
| TotalMolweight | 369.427 |
| Molweight | 369.427 |
| MonoisotopicMass | 369.15896 |
| CLogP | 3.133 |
| CLogS | -4.668 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 289.8 |
| Relative PSA | 0.23851 |
| PolarSurfaceArea | 85.3 |
| Druglikeness | 5.6773 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amines | 1 |
| Aromatic Amines | 1 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - 2-amino-N-[(E)-[2-(benzimidazol-1-yl)-1-phenylethylidene]amino]benzamide | 2 - 2-amino-N-[(E)-[2-(benzimidazol-1-yl)-1-phenylethylidene]amino]benzamide
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