| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 15 | Yes |
Popular Name: (1S,2R)-2-[(3S)-3-methyl-1-piperidyl]cyclohexanecarbonitrile (1S,2R)-2-[(3S)-3-methyl-1-piper…
| 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) | 3.05 | 8.27 | -39.45 | 1 | 2 | 1 | 28 | 207.341 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.05 | 6.35 | -6.58 | 0 | 2 | 0 | 27 | 206.333 | 1 | ↓ |
