2-[(E)-2-(2-chlorophenyl)ethenyl]-1-[(3-chlorophenyl)methyl]benzimidazole
Formula:C22H16N2Cl2
Mutagenic:none
Tumorigenic:high
Reproductive Effective:none
2-[(E)-2-(2-chlorophenyl)ethenyl]-1-[(3-chlorophenyl)methyl]benzimidazole is not a drug-like molecule.
| MolName | 2-[(E)-2-(2-chlorophenyl)ethenyl]-1-[(3-chlorophenyl)methyl]benzimidazole |
| MolecularFormula | C22H16N2Cl2 |
| Smiles | Clc1cccc(Cn2c(cccc3)c3nc2/C=C/c(cccc2)c2Cl)c1 |
| InChI | InChI=1S/C22H16Cl2N2/c23-18-8-5-6-16(14-18)15-26-21-11-4-3-10-20(21)25-22(26)13-12-17-7-1-2-9-19(17)24/h1-14H,15H2 |
| InChIK | WPMGQTLJRDIWLS-UHFFFAOYSA-N |
| TotalMolweight | 379.289 |
| Molweight | 379.289 |
| MonoisotopicMass | 378.069052 |
| CLogP | 6.058 |
| CLogS | -5.172 |
| H Acceptors | 2 |
| TotalSurfaceArea | 286.44 |
| Relative PSA | 0.062282 |
| PolarSurfaceArea | 17.82 |
| Druglikeness | 2.0768 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 1 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - 2-[(E)-2-(2-chlorophenyl)ethenyl]-1-[(3-chlorophenyl)methyl]benzimidazole | 2 - 2-[(E)-2-(2-chlorophenyl)ethenyl]-1-[(3-chlorophenyl)methyl]benzimidazole
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