| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 20 | Yes |
Popular Name: 4-[(1S)-1-[[(2S,4S,5R)-1,2,5-trimethyl-4-piperidyl]amino]ethyl]benzonitrile 4-[(1S)-1-[[(2S,4S,5R)-1,2,5-tri…
| 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) | 3.04 | 9.81 | -117.13 | 3 | 3 | 2 | 45 | 273.424 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.04 | 9.18 | -37.07 | 2 | 3 | 1 | 40 | 272.416 | 3 | ↓ |
