| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 20 | Yes |
Popular Name: 3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]ethoxy]benzonitrile 3-[2-[4-(2-hydroxyethyl)piperazi…
| 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 | 3.34 | -43.42 | 2 | 5 | 1 | 61 | 276.36 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 1.08 | -9.15 | 1 | 5 | 0 | 60 | 275.352 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 3.43 | -37.3 | 2 | 5 | 1 | 61 | 276.36 | 6 | ↓ |
