| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2010 | 13 | Yes |
Popular Name: (2R)-3-[4-(aminomethyl)-1-piperidyl]-2-methyl-propanenitrile (2R)-3-[4-(aminomethyl)-1-piperi…
| 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) | 0.45 | 4.37 | -106.04 | 4 | 3 | 2 | 56 | 183.299 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.45 | 2.5 | -48.67 | 3 | 3 | 1 | 55 | 182.291 | 3 | ↓ |
