| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2008 | 14 | No |
Popular Name: 5-methyl-4-[(1S,2S)-2-methylcyclohexyl]-1,2,4-triazole-3-thiol 5-methyl-4-[(1S,2S)-2-methylcycl…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.68 | 8.12 | -13.89 | 1 | 3 | 0 | 34 | 211.334 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.41 | 7.96 | -47.32 | 0 | 3 | -1 | 31 | 210.326 | 1 | ↓ |
