| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 28 | Yes |
Popular Name: (2S)-2-[4-[(S)-cyano-(4-methoxyphenyl)methyl]piperazin-1-yl]-2-(4-methoxyphenyl)acetonitrile (2S)-2-[4-[(S)-cyano-(4-methoxyp…
| 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) | 3.08 | 6.76 | -13.63 | 0 | 6 | 0 | 73 | 376.46 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.08 | 8.58 | -61.57 | 1 | 6 | 1 | 74 | 377.468 | 6 | ↓ |
