| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 22 | Yes |
Popular Name: 1-tert-butyl-6-(4-methyl-1,4-diazepan-1-yl)-5H-pyrazolo[3,4-d]pyrimidin-4-one 1-tert-butyl-6-(4-methyl-1,4-dia…
| 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) | 1.84 | 9.69 | -52.63 | 2 | 7 | 1 | 71 | 305.406 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 7.72 | -10.71 | 1 | 7 | 0 | 70 | 304.398 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,5-dihydropyrazolo[3,4-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/1171.gif)
![6-(1,4-diazepan-1-yl)-1,5-dihydropyrazolo[3,4-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/168514.gif)