| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 18 | Yes |
Popular Name: (2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)acetonitrile (2S)-2-(4-methoxyphenyl)-2-(4-me…
| 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) | 1.66 | 5.8 | -44.38 | 1 | 4 | 1 | 41 | 246.334 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.66 | 3.32 | -6.35 | 0 | 4 | 0 | 40 | 245.326 | 3 | ↓ |
