| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 25 | Yes |
| 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) | 0.67 | 7.96 | -86.12 | 2 | 7 | 1 | 77 | 349.407 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.67 | 5.27 | -42.05 | 1 | 7 | 0 | 76 | 348.399 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.67 | 2.7 | -53.14 | 0 | 7 | -1 | 74 | 347.391 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.67 | 5.39 | -59.85 | 1 | 7 | 0 | 76 | 348.399 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,2,3,3a,4,5,6,6a-octahydropyrrolo[3,4-c]pyrrole](http://zinc12.docking.org/img/rings/186766.gif)
![2-(2,3-dihydro-1,4-benzodioxin-7-ylmethyl)-3,3a,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole](http://zinc12.docking.org/img/rings/422104.gif)