| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 16 | Yes |
Popular Name: (1S,2R)-2-[(2S)-2-methyl-1-piperidyl]cycloheptanecarbonitrile (1S,2R)-2-[(2S)-2-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) | 3.64 | 7.71 | -37.56 | 1 | 2 | 1 | 28 | 221.368 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.64 | 6.09 | -6.38 | 0 | 2 | 0 | 27 | 220.36 | 1 | ↓ |
