| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2011 | 22 | 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) | 0.47 | -3.07 | -41.59 | 1 | 8 | -1 | 110 | 300.298 | 3 | ↓ |
| Ref Reference (pH 7) | 0.47 | -2.57 | -43.74 | 1 | 8 | -1 | 110 | 300.298 | 3 | ↓ |
| Ref Reference (pH 7) | 0.47 | -3.05 | -48.13 | 1 | 8 | -1 | 110 | 300.298 | 3 | ↓ |
| Ref Reference (pH 7) | 0.47 | -1.93 | -56.58 | 1 | 8 | -1 | 110 | 300.298 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3a,6a-dihydro-3H-pyrrolo[3,4-d]triazol-4-one](http://zinc12.docking.org/img/rings/506882.gif)
![2-(6-keto-3a,6a-dihydropyrrolo[3,4-d]triazol-1-yl)-N-phenyl-acetamide](http://zinc12.docking.org/img/rings/506881.gif)