| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 15 | Yes |
Popular Name: 2-[(1R,2S)-2-(2-keto-2-oxido-ethyl)-2-methyl-cyclohexyl]acetate 2-[(1R,2S)-2-(2-keto-2-oxido-eth…
| 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) | 1.74 | 0.95 | -99.62 | 0 | 4 | -2 | 80 | 212.245 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0639197A1; EP0639197B1; US5256814; WO1992010099A1 | IBM Patent Data |
