| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2010 | 20 | Yes |
Popular Name: (3R)-1-(2-cyanoethyl)-N-[(1S,2S)-2-methylcyclohexyl]piperidine-3-carboxamide (3R)-1-(2-cyanoethyl)-N-[(1S,2S)…
| 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) | 1.82 | 8.35 | -52.55 | 2 | 4 | 1 | 57 | 278.42 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 6.11 | -11.79 | 1 | 4 | 0 | 56 | 277.412 | 4 | ↓ |
