| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2011 | 45 | 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) | 4.46 | 13.55 | -24.25 | 3 | 8 | 0 | 113 | 610.73 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3,6,11,11a-tetrahydro-2H-pyrazino[1,2-b]isoquinoline-1,4-quinone](http://zinc12.docking.org/img/rings/197936.gif)
![2-[3-(cyclohexylmethyl)-1,4-diketo-3,6,11,11a-tetrahydropyrazino[1,2-b]isoquinolin-2-yl]-N-phenethyl-2-phenyl-acetamide](http://zinc12.docking.org/img/rings/197935.gif)