| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 18 | No |
Popular Name: 2-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]acetonitrile 2-[4-[2-oxo-2-(1-piperidyl)ethyl…
| 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) | 0.28 | 2.77 | -10.65 | 0 | 5 | 0 | 51 | 250.346 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.28 | 4.97 | -44.15 | 1 | 5 | 1 | 52 | 251.354 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
