| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 16 | Yes |
Popular Name: 2-[(2S)-2-methyl-1-piperidyl]-1-piperazin-1-yl-ethanone 2-[(2S)-2-methyl-1-piperidyl]-1-…
| 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) | 0.23 | 3.55 | -37.55 | 2 | 4 | 1 | 37 | 226.344 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.23 | 1.27 | -6.83 | 1 | 4 | 0 | 36 | 225.336 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.23 | 4.93 | -98.94 | 3 | 4 | 2 | 41 | 227.352 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
