| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 17 | Yes |
Popular Name: (1S,2R)-2-(4-propylpiperazin-1-yl)cyclohexanecarbonitrile (1S,2R)-2-(4-propylpiperazin-1-y…
| 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) | 2.67 | 6.94 | -39.79 | 1 | 3 | 1 | 31 | 236.383 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.67 | 4.7 | -6.99 | 0 | 3 | 0 | 30 | 235.375 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.67 | 6.65 | -40.19 | 1 | 3 | 1 | 31 | 236.383 | 3 | ↓ |
