| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 25 | No |
Popular Name: (9aS)-8-[3-(3H-pyrazol-4-yl)benzoyl]-2,3,6,7,9,9a-hexahydropyrazino[1,2-a]pyrazine-1,4-dione (9aS)-8-[3-(3H-pyrazol-4-yl)benz…
| 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) | -1.33 | 0.54 | -20.1 | 1 | 8 | 0 | 94 | 339.355 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,4,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine-6,9-quinone](http://zinc12.docking.org/img/rings/373582.gif)
![2-[3-(3H-pyrazol-4-yl)benzoyl]-1,3,4,7,8,9a-hexahydropyrazino[1,2-a]pyrazine-6,9-quinone](http://zinc12.docking.org/img/rings/407131.gif)