| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 20 | Yes |
Popular Name: (2S)-2-piperazin-1-yl-2-[2-(trifluoromethoxy)phenyl]acetonitrile (2S)-2-piperazin-1-yl-2-[2-(trif…
| 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) | 1.93 | 4.01 | -50.49 | 2 | 4 | 1 | 53 | 286.277 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 2.62 | -6.05 | 1 | 4 | 0 | 48 | 285.269 | 4 | ↓ |
