| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 28 | 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) | 0.95 | 4.21 | -32.21 | 2 | 8 | 0 | 99 | 388.399 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.41 | 2.3 | -52.8 | 1 | 8 | -1 | 102 | 387.391 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.95 | 6.54 | -75.65 | 3 | 8 | 1 | 100 | 389.407 | 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-[[2-keto-3-(3-phenylpropyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-d]oxazol-5-yl]methyl]uracil](http://zinc12.docking.org/img/rings/594381.gif)