| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2009 | 24 | Yes |
Popular Name: (2S)-2-(4-benzylpiperazin-1-yl)-4-phenyl-butan-1-amine (2S)-2-(4-benzylpiperazin-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) | 2.75 | 9.55 | -117.54 | 4 | 3 | 2 | 35 | 325.5 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | 7.22 | -45.79 | 3 | 3 | 1 | 34 | 324.492 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | 9.17 | -129.18 | 4 | 3 | 2 | 35 | 325.5 | 7 | ↓ |
