| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 14 | No |
Popular Name: (1S,2R)-2-(1,4-thiazepan-4-yl)cyclopentanecarbonitrile (1S,2R)-2-(1,4-thiazepan-4-yl)cy…
None
| 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) | 2.05 | 7.32 | -36.42 | 1 | 2 | 1 | 28 | 211.354 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.05 | 6.43 | -5.6 | 0 | 2 | 0 | 27 | 210.346 | 1 | ↓ |
