| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2011 | 20 | No |
Popular Name: 4-[(1R,3S,4S)-3,4-dimethylcyclohexyl]-5-phenyl-1,2,4-triazole-3-thiol 4-[(1R,3S,4S)-3,4-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) | 3.71 | 9.05 | -5.98 | 1 | 3 | 0 | 34 | 287.432 | 2 | ↓ |
| Mid Mid (pH 6-8) | 4.44 | 9.14 | -40.03 | 0 | 3 | -1 | 31 | 286.424 | 2 | ↓ |
