| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 23 | Yes |
Popular Name: ethyl ethyl
| 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) | 0.80 | 4.53 | -7.61 | 1 | 8 | 0 | 103 | 313.317 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.80 | 4.97 | -40.48 | 2 | 8 | 1 | 104 | 314.325 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Isoxazolo[5,4-d]pyrimidine](http://zinc12.docking.org/img/rings/86740.gif)
![Isoxazolo[5,4-d]pyrimidin-4-yl(3-pyridylmethyl)amine](http://zinc12.docking.org/img/rings/91576.gif)