| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 23 | Yes |
Popular Name: 5-[(4-ethyl-1,4-diazepan-1-yl)sulfonyl]-1,3-dimethyl-pyrazolo[3,4-b]pyridine 5-[(4-ethyl-1,4-diazepan-1-yl)su…
| 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) | 1.01 | 5.81 | -46.49 | 1 | 7 | 1 | 73 | 338.457 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.01 | 4.01 | -11.93 | 0 | 7 | 0 | 71 | 337.449 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-pyrazolo[3,4-b]pyridine](http://zinc12.docking.org/img/rings/3129.gif)
![5-(1,4-diazepan-1-ylsulfonyl)-1H-pyrazolo[3,4-b]pyridine](http://zinc12.docking.org/img/rings/399496.gif)