Chemical Name - Imidazole
Mol Weight - 68.0788
Smiles - c1cnc[nH]1
Mol Weight - 68.0788
Smiles - c1cnc[nH]1
| Property Value | |
| Mol Name | Imidazole |
| Molweight | 68.0788 |
| Monoisotopic Mass | 68.037448 |
| Clogp | -0.1802 |
| Clogs | -0.431 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 61.59 |
| Relative Psa | 0.40526 |
| Polar Surface Area | 28.68 |
| Druglikeness | 0.44659 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Shape Index | 0.6 |
| Molecular Complexity | 0.80472 |
| Fragments | 1 |
| Non H Atoms | 5 |
| Non Ch Atoms | 2 |
| Electronegative Atoms | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 5 |
| Aromatic Nitrogens | 2 |
| Basic Nitrogens | 1 |
| Smiles | c1cnc[nH]1 |
| InChIKey | InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5) |
| InChI | RAXXELZNTBOGNW-UHFFFAOYSA-N |
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