| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2006 | 20 | Yes |
Popular Name: 3-hydroxy-2-[1-(2-hydroxy-6-oxo-1-cyclohexenyl)-2-methyl-propyl]-cyclohex-2-en-1-one 3-hydroxy-2-[1-(2-hydroxy-6-oxo-…
| 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) | 1.80 | 7.14 | -13.58 | 0 | 4 | 0 | 68 | 278.348 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.96 | 8.3 | -108.43 | 0 | 4 | -2 | 80 | 276.332 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.96 | 7.22 | -52.37 | 1 | 4 | -1 | 77 | 277.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.96 | 7.03 | -47.33 | 1 | 4 | -1 | 77 | 277.34 | 3 | ↓ |
