| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 17 | Yes |
Popular Name: 3-[4-(5-methyl-2-pyridyl)piperazin-1-yl]propan-1-amine 3-[4-(5-methyl-2-pyridyl)piperaz…
| 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) | 0.56 | 5.94 | -174.9 | 5 | 4 | 3 | 49 | 237.371 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.56 | 3.02 | -4.94 | 2 | 4 | 0 | 45 | 234.347 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.56 | 3.39 | -47.02 | 3 | 4 | 1 | 47 | 235.355 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.56 | 5.63 | -111.25 | 4 | 4 | 2 | 48 | 236.363 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.56 | 3.71 | -80.57 | 4 | 4 | 2 | 48 | 236.363 | 4 | ↓ |
