| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 27 | Yes |
Popular Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(4-ethylpiperazin-1-yl)ethanone 2-[4-(1,3-benzodioxol-5-ylmethyl…
| 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) | 1.14 | 7.39 | -94.16 | 2 | 7 | 2 | 51 | 376.501 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.14 | 2.91 | -10.54 | 0 | 7 | 0 | 48 | 374.485 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 5.12 | -46.08 | 1 | 7 | 1 | 50 | 375.493 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 5.18 | -45.19 | 1 | 7 | 1 | 50 | 375.493 | 5 | ↓ |
