| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2008 | 26 | Yes |
Popular Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(3-bromo-4-methoxy-phenyl)methyl]piperazine 1-(1,3-benzodioxol-5-ylmethyl)-4…
| 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) | 3.72 | 8.04 | -49.15 | 1 | 5 | 1 | 35 | 420.327 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.72 | 7.98 | -46.37 | 1 | 5 | 1 | 35 | 420.327 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.72 | 5.66 | -8.76 | 0 | 5 | 0 | 34 | 419.319 | 5 | ↓ |
