| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2010 | 20 | Yes |
Popular Name: 3-[(3S)-3-[(2S)-2-ethylpiperidine-1-carbonyl]-1-piperidyl]propanenitrile 3-[(3S)-3-[(2S)-2-ethylpiperidin…
| 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) | 1.70 | 8.88 | -52.74 | 1 | 4 | 1 | 49 | 278.42 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 6.65 | -11.11 | 0 | 4 | 0 | 47 | 277.412 | 4 | ↓ |
