| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2011 | 25 | Yes |
Popular Name: 2-[4-[4-(2-pyridylmethyl)piperazin-1-yl]pyrazolo[3,4-d]pyrimidin-1-yl]ethanol 2-[4-[4-(2-pyridylmethyl)piperaz…
| 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) | -0.20 | 3.64 | -9.68 | 1 | 8 | 0 | 83 | 339.403 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.20 | 5.86 | -43.95 | 2 | 8 | 1 | 84 | 340.411 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.20 | 4.37 | -38.19 | 2 | 8 | 1 | 84 | 340.411 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-pyrazolo[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/1523.gif)
![4-[4-(2-pyridylmethyl)piperazino]-1H-pyrazolo[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/430074.gif)