| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 29 | Yes |
Popular Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(3R)-1-(1-methyl-4-piperidyl)-3-piperidyl]piperazine 1-(1,3-benzodioxol-5-ylmethyl)-4…
None
| 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) | 2.36 | 7.84 | -87.22 | 2 | 6 | 2 | 34 | 402.583 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 7.77 | -89.4 | 2 | 6 | 2 | 34 | 402.583 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 5.51 | -38.49 | 1 | 6 | 1 | 33 | 401.575 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.36 | 10.08 | -174.55 | 3 | 6 | 3 | 35 | 403.591 | 4 | ↓ |
