| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2011 | 25 | 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) | -0.46 | 2.36 | -56.41 | 1 | 9 | 1 | 85 | 352.415 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.46 | -0.1 | -16.82 | 0 | 9 | 0 | 84 | 351.407 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.46 | 4.62 | -109.79 | 2 | 9 | 2 | 87 | 353.423 | 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)
![3-(3-morpholinopropyl)-5-(1,2,4-oxadiazol-3-ylmethyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-d]oxazol-2-one](http://zinc12.docking.org/img/rings/539358.gif)