| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2011 | 30 | 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) | 0.78 | 9.69 | -52.63 | 2 | 8 | 0 | 113 | 410.426 | 5 | ↓ |
| Ref Reference (pH 7) | 0.78 | 8.31 | -43.09 | 2 | 8 | 0 | 113 | 410.426 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.78 | 9.01 | -57.25 | 1 | 8 | -1 | 108 | 409.418 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.78 | 8.11 | -49.43 | 1 | 8 | -1 | 108 | 409.418 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-c]pyrrole-1,3-quinone](http://zinc12.docking.org/img/rings/13557.gif)
![3,5-diphenyl-2,3,3a,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole-4,6-quinone](http://zinc12.docking.org/img/rings/42707.gif)