| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 26th, 2009 | 13 | Yes |
Popular Name: (1S,2R)-2-(1H-1,2,4-triazol-5-ylsulfanyl)cyclohexanol (1S,2R)-2-(1H-1,2,4-triazol-5-yl…
| 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) | 1.07 | 3.23 | -6.12 | 2 | 4 | 0 | 62 | 199.279 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 2.87 | -42.57 | 1 | 4 | -1 | 60 | 198.271 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
