| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 22nd, 2011 | 23 | Yes |
Popular Name: 1-phenyl-6-(4H-1,2,4-triazol-3-ylsulfanylmethyl)-5H-pyrazolo[3,4-d]pyrimidin-4-one 1-phenyl-6-(4H-1,2,4-triazol-3-y…
| 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) | 1.34 | 4.84 | -45.19 | 1 | 8 | -1 | 108 | 324.349 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 7.32 | -17.46 | 2 | 8 | 0 | 105 | 325.357 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-pyrazolo[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/1523.gif)
![1-phenyl-6-[(1H-1,2,4-triazol-5-ylthio)methyl]pyrazolo[3,4-d]pyrimidine](http://zinc12.docking.org/img/rings/442486.gif)