| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 32 | 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) | 2.31 | 6.68 | -49.25 | 2 | 10 | 1 | 107 | 441.512 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.31 | 4.31 | -8.29 | 1 | 10 | 0 | 106 | 440.504 | 9 | ↓ |
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-[2-(4-phenylpiperazino)ethyl]amine](http://zinc12.docking.org/img/rings/91592.gif)