| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 27 | 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) | 2.21 | 4.38 | -13.07 | 1 | 8 | 0 | 94 | 428.246 | 4 | ↓ |
| Ref Reference (pH 7) | 2.21 | 4.42 | -14.79 | 1 | 8 | 0 | 94 | 428.246 | 4 | ↓ |
| Ref Reference (pH 7) | 2.21 | 5.53 | -20.3 | 1 | 8 | 0 | 94 | 428.246 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 3.53 | -54.76 | 2 | 8 | 1 | 96 | 429.254 | 4 | ↓ |
![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)
