| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2006 | 18 | No |
Popular Name: 2-(3,3-dimethylbutanoyl)-4-tert-butyl-cyclohexan-1-one 2-(3,3-dimethylbutanoyl)-4-tert-…
| 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) | 4.33 | 7.54 | -40.61 | 0 | 2 | -1 | 40 | 251.39 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.33 | 4.35 | -7.77 | 1 | 2 | 0 | 37 | 252.398 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.74 | 4.05 | -6.28 | 0 | 2 | 0 | 34 | 252.398 | 4 | ↓ |
