| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 23 | Yes |
Popular Name: N-[(4-fluorophenyl)methyl]-6-hydroxy-2-methyl-7-oxo-isoxazolo[2,3-a]pyrimidine-5-carboxamide N-[(4-fluorophenyl)methyl]-6-hyd…
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) | 1.27 | 5.12 | -15.37 | 2 | 7 | 0 | 97 | 317.276 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 6.06 | -57.9 | 1 | 7 | -1 | 100 | 316.268 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Isoxazolo[2,3-a]pyrimidin-7-one](http://zinc12.docking.org/img/rings/89281.gif)
![N-benzyl-7-keto-isoxazolo[2,3-a]pyrimidine-5-carboxamide](http://zinc12.docking.org/img/rings/366620.gif)