| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 23 | Yes |
Popular Name: 4-[[5-[4-(2-hydroxyethyl)piperazin-1-yl]-2-pyridyl]amino]-4-oxo-butanoic 4-[[5-[4-(2-hydroxyethyl)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) | -0.46 | -0.15 | -58.32 | 2 | 8 | -1 | 109 | 321.357 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.46 | 2.23 | -81.47 | 3 | 8 | 0 | 110 | 322.365 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -0.46 | 1.11 | -50.42 | 4 | 8 | 1 | 107 | 323.373 | 7 | ↓ |
