| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2009 | 17 | No |
Popular Name: 3-[(3S,5S)-5-(2-cyanoethyl)-1,5-dimethyl-4-oxo-3-piperidyl]propanenitrile 3-[(3S,5S)-5-(2-cyanoethyl)-1,5-…
| 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) | -0.19 | 5.7 | -14.31 | 0 | 4 | 0 | 68 | 233.315 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.19 | 7.89 | -60.26 | 1 | 4 | 1 | 69 | 234.323 | 4 | ↓ |
