| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 17 | Yes |
Popular Name: (2S)-2-(4-bromophenyl)-2-(4-methylpiperazin-1-yl)acetonitrile (2S)-2-(4-bromophenyl)-2-(4-meth…
| 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) | 2.41 | 7.1 | -44.29 | 1 | 3 | 1 | 31 | 295.204 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.41 | 4.62 | -5.4 | 0 | 3 | 0 | 30 | 294.196 | 2 | ↓ |
