| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 29 | 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) | 3.08 | 6.24 | -15.7 | 1 | 8 | 0 | 94 | 456.3 | 5 | ↓ |
| Ref Reference (pH 7) | 3.08 | 6.31 | -13.24 | 1 | 8 | 0 | 94 | 456.3 | 5 | ↓ |
| Ref Reference (pH 7) | 3.08 | 6.44 | -20.64 | 1 | 8 | 0 | 94 | 456.3 | 5 | ↓ |
| Ref Reference (pH 7) | 3.08 | 6.56 | -14.03 | 1 | 8 | 0 | 94 | 456.3 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3a,6a-dihydro-3H-pyrrolo[3,4-d]triazole-4,6-quinone](http://zinc12.docking.org/img/rings/4107.gif)
![2-(4,6-diketo-5-phenyl-3a,6a-dihydropyrrolo[3,4-d]triazol-1-yl)-N-phenyl-acetamide](http://zinc12.docking.org/img/rings/4106.gif)