| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2009 | 20 | Yes |
Popular Name: (2S)-2-[(4-phenylpiperazin-1-yl)methyl]pentanedinitrile (2S)-2-[(4-phenylpiperazin-1-yl)…
| 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) | 1.82 | 6.51 | -15.2 | 0 | 4 | 0 | 54 | 268.364 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 8.55 | -59.66 | 1 | 4 | 1 | 55 | 269.372 | 5 | ↓ |
