| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 20 | Yes |
Popular Name: 1-(1,3-benzodioxol-5-yl)-2-(4-ethylpiperazin-1-yl)ethanone 1-(1,3-benzodioxol-5-yl)-2-(4-et…
| 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) | 1.65 | 5.32 | -41.22 | 1 | 5 | 1 | 43 | 277.344 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 3.04 | -10.6 | 0 | 5 | 0 | 42 | 276.336 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 5.24 | -46.72 | 1 | 5 | 1 | 43 | 277.344 | 4 | ↓ |
