| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 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) | 4.05 | 9.1 | -9.72 | 1 | 7 | 0 | 79 | 450.878 | 4 | ↓ |
| Ref Reference (pH 7) | 4.05 | 9.27 | -14.05 | 1 | 7 | 0 | 79 | 450.878 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,3a,6a-tetrahydropyrrolo[3,4-d]isoxazole-4,6-quinone](http://zinc12.docking.org/img/rings/39901.gif)
![2,3,5-triphenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-quinone](http://zinc12.docking.org/img/rings/39900.gif)