| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: 4-piperidyl-[4-(2-pyridylmethyl)piperazin-1-yl]methanone 4-piperidyl-[4-(2-pyridylmethyl)…
| 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) | -0.01 | 3.85 | -49.54 | 2 | 5 | 1 | 53 | 289.403 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.01 | 4.59 | -86.05 | 3 | 5 | 2 | 54 | 290.411 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.01 | 6.07 | -98.5 | 3 | 5 | 2 | 54 | 290.411 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.01 | 6.83 | -179.22 | 4 | 5 | 3 | 55 | 291.419 | 3 | ↓ |
