| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 26th, 2008 | 29 | 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) | 2.28 | 10.4 | -49.15 | 1 | 6 | 1 | 55 | 408.448 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 8.15 | -13.93 | 0 | 6 | 0 | 54 | 407.44 | 4 | ↓ |
![1H-pyrazolo[3,4-b]pyridine](http://zinc12.docking.org/img/rings/3129.gif)
![1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine](http://zinc12.docking.org/img/rings/3890.gif)
![1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-(6-cyclopropylpyrazolo[3,4-b]pyridin-1-yl)ethanone](http://zinc12.docking.org/img/rings/73764.gif)
