| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 37 | 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) | 1.99 | 13.66 | -51.48 | 1 | 9 | 1 | 84 | 518.045 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 11.37 | -11.68 | 0 | 9 | 0 | 83 | 517.037 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-pyrazolo[3,4-b]pyridine](http://zinc12.docking.org/img/rings/3129.gif)
![5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine](http://zinc12.docking.org/img/rings/9075.gif)
![[4-(6-benzyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)piperazino]-(1H-pyrazolo[3,4-b]pyridin-5-yl)methanone](http://zinc12.docking.org/img/rings/604637.gif)