| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 21 | Yes |
Popular Name: 1-[[(2S)-1-methyl-2-piperidyl]methyl]-4-(4-pyridylmethyl)piperazine 1-[[(2S)-1-methyl-2-piperidyl]me…
| 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) | 1.27 | 8.32 | -99 | 2 | 4 | 2 | 25 | 290.455 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 3.48 | -3.78 | 0 | 4 | 0 | 23 | 288.439 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 7.53 | -37.27 | 1 | 4 | 1 | 24 | 289.447 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 8.03 | -110.24 | 2 | 4 | 2 | 25 | 290.455 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 5.98 | -31.73 | 1 | 4 | 1 | 24 | 289.447 | 4 | ↓ |
