1-benzyl-2-[(E)-2-phenylethenyl]benzimidazole
Formula:C22H18N2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
1-benzyl-2-[(E)-2-phenylethenyl]benzimidazole is a drug-like molecule.
| MolName | 1-benzyl-2-[(E)-2-phenylethenyl]benzimidazole |
| MolecularFormula | C22H18N2 |
| Smiles | C(c1ccccc1)n1c(cccc2)c2nc1/C=C/c1ccccc1 |
| InChI | InChI=1S/C22H18N2/c1-3-9-18(10-4-1)15-16-22-23-20-13-7-8-14-21(20)24(22)17-19-11-5-2-6-12-19/h1-16H,17H2 |
| InChIK | SSQBXNWNNOTSQE-UHFFFAOYSA-N |
| TotalMolweight | 310.399 |
| Molweight | 310.399 |
| MonoisotopicMass | 310.146998 |
| CLogP | 4.846 |
| CLogS | -3.7 |
| H Acceptors | 2 |
| TotalSurfaceArea | 255.6 |
| Relative PSA | 0.069797 |
| PolarSurfaceArea | 17.82 |
| Druglikeness | 2.04 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54167 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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