Mol Weight - 118.139
Smiles - c1c[nH]c2ncccc12
| Property Name | Property Value |
| Mol Name | (1H-Pyrrolo(2,3-b)Pyridine) |
| Molweight | 118.139 |
| Monoisotopic Mass | 118.053098 |
| Clogp | 0.981 |
| Clogs | -2.191 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 96.19 |
| Relative Psa | 0.25949 |
| Polar Surface Area | 28.68 |
| Druglikeness | -0.69049 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.55556 |
| Molecular Complexity | 0.72752 |
| Fragments | 1 |
| Non H Atoms | 9 |
| Non Ch Atoms | 2 |
| Electronegative Atoms | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 9 |
| Aromatic Nitrogens | 2 |
| Smiles | c1c[nH]c2ncccc12 |
| InChIKey | InChI=1S/C7H6N2/c1-2-6-3-5-9-7(6)8-4-1/h1-5H,(H,8,9) |
| InChI | MVXVYAKCVDQRLW-UHFFFAOYSA-N |
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1 — (1H-Pyrrolo(2,3-b)Pyridine) | 2 — (1H-Pyrrolo(2,3-b)Pyridine)