In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2008 | 18 | No |
Popular Name: 2,2,4,4-tetramethyl-6-(2-methylpropanoyl)cyclohexane-1,3,5-trione 2,2,4,4-tetramethyl-6-(2-methylp…
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) | 1.25 | 6.83 | -40.52 | 0 | 4 | -1 | 74 | 251.302 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.25 | 6.83 | -40.52 | 0 | 4 | -1 | 74 | 251.302 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.66 | 6.83 | -12.91 | 0 | 4 | 0 | 68 | 252.31 | 2 | ↓ |