| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2005 | 20 | Yes |
Popular Name: 4-methyl-5-oxo-3-phenyl-cyclohexane-1,2-dicarboxylic 4-methyl-5-oxo-3-phenyl-cyclohex…
| 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) | 1.66 | 6.68 | -133.43 | 0 | 5 | -2 | 97 | 274.272 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.66 | 5.55 | -61.23 | 1 | 5 | -1 | 94 | 275.28 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.66 | 5.56 | -50.08 | 1 | 5 | -1 | 94 | 275.28 | 3 | ↓ |
