| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 25 | No |
None
| 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) | -0.09 | 5.2 | -50.87 | 2 | 8 | 1 | 75 | 350.443 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.09 | 5.71 | -123.62 | 3 | 8 | 2 | 76 | 351.451 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.09 | 2.95 | -47.79 | 2 | 8 | 1 | 75 | 350.443 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.09 | 2.49 | -19.78 | 1 | 8 | 0 | 74 | 349.435 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -0.09 | 7.52 | -116.46 | 3 | 8 | 2 | 76 | 351.451 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3,3a,4,5,6,6a-hexahydropyrrolo[3,4-d]oxazol-2-one](http://zinc12.docking.org/img/rings/22483.gif)
![5-(1H-imidazol-4-ylmethyl)-3-(3-morpholinopropyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-d]oxazol-2-one](http://zinc12.docking.org/img/rings/594664.gif)