| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2010 | 21 | Yes |
Popular Name: 3-[(3S)-3-[(2S)-2-(2-hydroxyethyl)piperidine-1-carbonyl]-1-piperidyl]propanenitrile 3-[(3S)-3-[(2S)-2-(2-hydroxyethy…
| 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) | 0.46 | 5.56 | -55.25 | 2 | 5 | 1 | 69 | 294.419 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.46 | 3.31 | -14.92 | 1 | 5 | 0 | 68 | 293.411 | 5 | ↓ |
