| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 19 | Yes |
Popular Name: (3S)-1-[(1R,2R,5R)-2-cyano-5-ethyl-cyclohexyl]piperidine-3-carboxamide (3S)-1-[(1R,2R,5R)-2-cyano-5-eth…
| 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) | 2.09 | 5.59 | -41.53 | 3 | 4 | 1 | 71 | 264.393 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.09 | 3.72 | -10.42 | 2 | 4 | 0 | 70 | 263.385 | 3 | ↓ |
