| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2010 | 20 | Yes |
Popular Name: 1-(2-cyanoethyl)-N-(4-pyridylmethyl)piperidine-4-carboxamide 1-(2-cyanoethyl)-N-(4-pyridylmet…
| 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) | -0.21 | 6.08 | -58.17 | 2 | 5 | 1 | 70 | 273.36 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.21 | 3.82 | -12.53 | 1 | 5 | 0 | 69 | 272.352 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.21 | 6.54 | -103.2 | 3 | 5 | 2 | 71 | 274.368 | 5 | ↓ |
