| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 23 | Yes |
Popular Name: (2R)-2-amino-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-butan-1-one (2R)-2-amino-1-[4-(1,3-benzodiox…
| 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) | 0.83 | 2.67 | -48.2 | 3 | 6 | 1 | 70 | 320.413 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | 2.38 | -12.43 | 2 | 6 | 0 | 68 | 319.405 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.83 | 4.93 | -111.81 | 4 | 6 | 2 | 71 | 321.421 | 4 | ↓ |
