| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 23 | Yes |
Popular Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]-4-methyl-piperazine 1-[1-(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) | 1.94 | 7.46 | -92.26 | 2 | 5 | 2 | 31 | 319.449 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 4.99 | -45.45 | 1 | 5 | 1 | 29 | 318.441 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 7.25 | -113.1 | 2 | 5 | 2 | 31 | 319.449 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 7.23 | -11.74 | 0 | 5 | 0 | 52 | 316.401 | 4 | ↓ |
