| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 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) | 2.08 | 2.2 | -46.76 | 3 | 6 | 1 | 74 | 344.483 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 3.2 | -42.17 | 3 | 6 | 1 | 70 | 344.483 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.08 | 4.64 | -114.86 | 4 | 6 | 2 | 75 | 345.491 | 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)
![3,4,5,6-tetrahydrocyclopenta[c]pyrazole](http://zinc12.docking.org/img/rings/397695.gif)
![5-cyclopentyl-N-(3,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylmethyl)-1,2,3,3a,4,6-hexahydropyrrolo[3,4-c]pyrrole-6a-carboxamide](http://zinc12.docking.org/img/rings/405949.gif)