| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2006 | 19 | No |
Popular Name: 3-hydroxy-2-[1-(2-hydroxy-6-oxo-1-cyclohexenyl)prop-2-ynyl]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) | 1.24 | 7.84 | -120.14 | 0 | 4 | -2 | 80 | 258.273 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.24 | 6.15 | -53.94 | 1 | 4 | -1 | 77 | 259.281 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.66 | 6.67 | -43.11 | 0 | 4 | -1 | 74 | 259.281 | 2 | ↓ |
