| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | No |
Popular Name: (1S,2S)-2-(1,4-thiazepan-4-yl)cyclohexanecarbonitrile (1S,2S)-2-(1,4-thiazepan-4-yl)cy…
| 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) | 2.56 | 8.12 | -38.99 | 1 | 2 | 1 | 28 | 225.381 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 6.46 | -6.3 | 0 | 2 | 0 | 27 | 224.373 | 1 | ↓ |
