| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 24th, 2011 | 29 | Yes |
| 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) | 4.46 | 13.81 | -47.59 | 1 | 3 | 1 | 13 | 396.505 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.46 | 11.55 | -7.08 | 0 | 3 | 0 | 11 | 395.497 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.46 | 12.99 | -40.87 | 1 | 3 | 1 | 13 | 396.505 | 6 | ↓ |
![1-benzyl-4-[(1-benzylpyrrol-2-yl)methyl]piperazine](http://zinc12.docking.org/img/rings/173271.gif)
