| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | Yes |
Popular Name: 2-(dimethylamino)-1-[4-[(2S)-piperidine-2-carbonyl]piperazin-1-yl]ethanone 2-(dimethylamino)-1-[4-[(2S)-pip…
| 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) | -0.41 | 4.95 | -86.42 | 3 | 6 | 2 | 62 | 284.404 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.41 | 3.71 | -44.62 | 2 | 6 | 1 | 57 | 283.396 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.41 | 2.55 | -43.29 | 2 | 6 | 1 | 60 | 283.396 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.41 | 1.31 | -11.42 | 1 | 6 | 0 | 56 | 282.388 | 3 | ↓ |
