| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2010 | 23 | Yes |
Popular Name: N-[(2S)-2-cyanopropyl]-N-ethyl-2-[4-(2-pyridyl)piperazin-1-yl]acetamide N-[(2S)-2-cyanopropyl]-N-ethyl-2…
| 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) | 1.29 | 7.51 | -37.48 | 1 | 6 | 1 | 65 | 316.429 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.29 | 7.19 | -13.48 | 0 | 6 | 0 | 63 | 315.421 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.29 | 9.37 | -49.03 | 1 | 6 | 1 | 65 | 316.429 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.29 | 9.68 | -103.79 | 2 | 6 | 2 | 66 | 317.437 | 6 | ↓ |
