| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 24 | Yes |
Popular Name: 1-[[4-[(4-cyano-1-piperidyl)methyl]phenyl]methyl]piperidine-4-carbonitrile 1-[[4-[(4-cyano-1-piperidyl)meth…
| 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) | 2.66 | 12.6 | -113.23 | 2 | 4 | 2 | 56 | 324.472 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.66 | 8.13 | -10.78 | 0 | 4 | 0 | 54 | 322.456 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 10.37 | -53.91 | 1 | 4 | 1 | 55 | 323.464 | 4 | ↓ |
