| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 18 | Yes |
Popular Name: 3-[(2S)-4-methyl-2-phenyl-piperazin-1-yl]-3-oxo-propanenitrile 3-[(2S)-4-methyl-2-phenyl-pipera…
| 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) | 0.59 | 4.98 | -15.73 | 0 | 4 | 0 | 47 | 243.31 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 7.36 | -62.93 | 1 | 4 | 1 | 49 | 244.318 | 2 | ↓ |
