| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 23 | No |
| 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) | -0.46 | -0.2 | -50.94 | 1 | 10 | -1 | 132 | 321.269 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.46 | 0.41 | -125.83 | 0 | 10 | -2 | 135 | 320.261 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.46 | -0.79 | -22.05 | 2 | 10 | 0 | 129 | 322.277 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.46 | -0.18 | -47.79 | 1 | 10 | -1 | 132 | 321.269 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Isoxazolo[5,4-b]pyridine](http://zinc12.docking.org/img/rings/7243.gif)
![N'-(tetrahydrofuran-2-carbonyl)isoxazolo[5,4-b]pyridine-5-carbohydrazide](http://zinc12.docking.org/img/rings/517875.gif)