| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 27 | Yes |
Popular Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-bromo-6-methoxy-phenol 4-[[4-(1,3-benzodioxol-5-ylmethy…
| 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) | 3.23 | 5.86 | -48.52 | 2 | 6 | 1 | 56 | 436.326 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 4.5 | -47.12 | 0 | 6 | -1 | 57 | 434.31 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 5.85 | -47.88 | 2 | 6 | 1 | 56 | 436.326 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 3.59 | -9.05 | 1 | 6 | 0 | 54 | 435.318 | 5 | ↓ |
