| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 14th, 2009 | 32 | 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) | 4.03 | 12.44 | -41.49 | 2 | 8 | 1 | 96 | 436.536 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 12.11 | -16.23 | 1 | 8 | 0 | 94 | 435.528 | 4 | ↓ |
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-cyclohexyl-3-(2-pyridyl)-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide](http://zinc12.docking.org/img/rings/42057.gif)