| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 18 | Yes |
Popular Name: 1-Benzyl-4-(cyanomethyl)piperidine-4-carbonitrile 1-Benzyl-4-(cyanomethyl)piperidi…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 86945-27-9 , [86945-27-9]
| 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) | 1.46 | 8.98 | -55.48 | 1 | 3 | 1 | 52 | 240.33 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.46 | 6.72 | -14.73 | 0 | 3 | 0 | 51 | 239.322 | 3 | ↓ |
