| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 25 | Yes |
Popular Name: 4-[4-(4-methoxyphenyl)-1,4-diazepan-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidine 4-[4-(4-methoxyphenyl)-1,4-diaze…
| 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) | 2.23 | 8.96 | -13.52 | 0 | 7 | 0 | 59 | 338.415 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 9.84 | -41.33 | 1 | 7 | 1 | 61 | 339.423 | 3 | ↓ |
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-phenyl-1,4-diazepan-1-yl)-1H-pyrazolo[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/248409.gif)