| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2008 | 20 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-2-[(3R,5S)-3,5-dimethyl-1-piperidyl]ethanamine (1S)-1-(1,3-benzodioxol-5-yl)-2-…
| 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) | 0.97 | 5.74 | -36.01 | 3 | 4 | 1 | 49 | 277.388 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.97 | 6.03 | -133.09 | 4 | 4 | 2 | 51 | 278.396 | 3 | ↓ |
