| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2008 | 17 | No |
Popular Name: 4-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-5-propyl-1,2,4-triazole-3-thiol 4-[(1S,2S,3S)-2,3-dimethylcycloh…
| 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) | 3.00 | 9.6 | -12.2 | 1 | 3 | 0 | 34 | 253.415 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.72 | 9.44 | -47.01 | 0 | 3 | -1 | 31 | 252.407 | 3 | ↓ |
