| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2010 | 22 | Yes |
Popular Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-but-2-en-1-one 1-[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) | 2.52 | 5.61 | -11.65 | 0 | 5 | 0 | 42 | 302.374 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 7.83 | -51.97 | 1 | 5 | 1 | 43 | 303.382 | 3 | ↓ |
