| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 14th, 2009 | 34 | No |
| 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) | 3.68 | 12.82 | -44.7 | 2 | 8 | 1 | 96 | 462.505 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.68 | 12.49 | -16.42 | 1 | 8 | 0 | 94 | 461.497 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline](http://zinc12.docking.org/img/rings/41406.gif)
![N-benzyl-3-(2-pyridyl)-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide](http://zinc12.docking.org/img/rings/42063.gif)