| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 19 | Yes |
Popular Name: (4S)-4-(3-chloro-4-hydroxy-phenyl)-1-methyl-5,7-dihydro-4H-pyrazolo[3,4-b]pyridin-6-one (4S)-4-(3-chloro-4-hydroxy-pheny…
None
| 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) | 1.89 | 0.68 | -9.88 | 2 | 5 | 0 | 71 | 277.711 | 1 | ↓ |
| Ref Reference (pH 7) | 1.70 | 3.31 | -10.86 | 2 | 5 | 0 | 67 | 277.711 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.89 | 1.45 | -47.48 | 1 | 5 | -1 | 73 | 276.703 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 4.07 | -49.09 | 1 | 5 | -1 | 70 | 276.703 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,5-dihydro-1H-pyrazolo[3,4-b]pyridine](http://zinc12.docking.org/img/rings/12109.gif)
![4-phenyl-4,5-dihydro-1H-pyrazolo[3,4-b]pyridine](http://zinc12.docking.org/img/rings/582448.gif)