| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2011 | 14 | No |
Popular Name: (2S)-1-[(1S)-2-cyclopropyl-1-methyl-ethyl]-2-methyl-piperidin-4-one (2S)-1-[(1S)-2-cyclopropyl-1-met…
| 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) | 1.72 | 7.49 | -37.19 | 1 | 2 | 1 | 22 | 196.314 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 5.61 | -3.83 | 0 | 2 | 0 | 20 | 195.306 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
