| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 21 | Yes |
Popular Name: 3-[4-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]piperazin-1-yl]propanoic 3-[4-[2-(4-methylpiperazin-1-yl)…
| 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) | -1.01 | 3.47 | -49.01 | 1 | 7 | 0 | 71 | 298.387 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.01 | 1.18 | -50.31 | 0 | 7 | -1 | 70 | 297.379 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.01 | 5.81 | -90.56 | 2 | 7 | 1 | 73 | 299.395 | 5 | ↓ |
