(E)-N-(benzimidazol-1-yl)-1-phenylmethanimine
Formula:C14H11N3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-N-(benzimidazol-1-yl)-1-phenylmethanimine is a drug-like molecule.
| MolName | (E)-N-(benzimidazol-1-yl)-1-phenylmethanimine |
| MolecularFormula | C14H11N3 |
| Smiles | C(c1ccccc1)=N/n1c(cccc2)c2nc1 |
| InChI | InChI=1S/C14H11N3/c1-2-6-12(7-3-1)10-16-17-11-15-13-8-4-5-9-14(13)17/h1-11H |
| InChIK | OPGLONOADIEPAF-UHFFFAOYSA-N |
| TotalMolweight | 221.262 |
| Molweight | 221.262 |
| MonoisotopicMass | 221.095297 |
| CLogP | 3.058 |
| CLogS | -5.571 |
| H Acceptors | 3 |
| TotalSurfaceArea | 180.34 |
| Relative PSA | 0.16275 |
| PolarSurfaceArea | 30.18 |
| Druglikeness | 3.8706 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.64706 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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