Chemical Name - Tricyclazole
Mol Weight - 189.242
Smiles - Cc1cccc(s2)c1n1c2nnc1
Mol Weight - 189.242
Smiles - Cc1cccc(s2)c1n1c2nnc1
| Property Value | |
| Mol Name | Tricyclazole |
| Molweight | 189.242 |
| Monoisotopic Mass | 189.036067 |
| Clogp | 1.8635 |
| Clogs | -2.08 |
| H Acceptors | 3 |
| Total Surface Area | 138.83 |
| Relative Psa | 0.36195 |
| Polar Surface Area | 58.43 |
| Druglikeness | 2.269 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 0.53846 |
| Molecular Complexity | 0.80343 |
| Fragments | 1 |
| Non H Atoms | 13 |
| Non Ch Atoms | 4 |
| Electronegative Atoms | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 12 |
| Sp3 Atoms | 1 |
| Aromatic Nitrogens | 3 |
| Smiles | Cc1cccc(s2)c1n1c2nnc1 |
| InChIKey | InChI=1S/C9H7N3S/c1-6-3-2-4-7-8(6)12-5-10-11-9(12)13-7/h2-5H,1H3 |
| InChI | DQJCHOQLCLEDLL-UHFFFAOYSA-N |
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1 - Tricyclazole
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