| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 27th, 2010 | 15 | Yes |
Popular Name: (2S)-3-[4-(dimethylaminomethyl)-1-piperidyl]-2-methyl-propanenitrile (2S)-3-[4-(dimethylaminomethyl)-…
| 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) | 1.68 | 8.41 | -105.17 | 2 | 3 | 2 | 33 | 211.353 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.68 | 6.47 | -39.49 | 1 | 3 | 1 | 31 | 210.345 | 4 | ↓ |
