| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 26th, 2008 | 23 | Yes |
Popular Name: 3-[[4-(piperidine-1-carbonyl)-1-piperidyl]methyl]benzonitrile 3-[[4-(piperidine-1-carbonyl)-1-…
| 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) | 2.50 | 10.67 | -56.64 | 1 | 4 | 1 | 49 | 312.437 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 8.43 | -13.31 | 0 | 4 | 0 | 47 | 311.429 | 3 | ↓ |
