| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 15 | No |
Popular Name: 5-methyl-4-[[(1R,2R)-2-methylcyclohexyl]methyl]-1,2,4-triazole-3-thiol 5-methyl-4-[[(1R,2R)-2-methylcyc…
| 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) | 2.06 | 8.01 | -12.36 | 1 | 3 | 0 | 34 | 225.361 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.79 | 8.14 | -48.27 | 0 | 3 | -1 | 31 | 224.353 | 2 | ↓ |
