| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2011 | 14 | Yes |
Popular Name: 1-[(1S,2R,4S)-2,4-dimethylcyclohexyl]pyrrolidin-3-one 1-[(1S,2R,4S)-2,4-dimethylcycloh…
| 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) | 1.80 | 7.16 | -39.75 | 1 | 2 | 1 | 22 | 196.314 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 5.08 | -3.43 | 0 | 2 | 0 | 20 | 195.306 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
