| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2008 | 38 | Yes |
| 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) | 3.51 | 12.31 | -25.79 | 0 | 8 | 0 | 81 | 518.61 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.51 | 14.58 | -76.3 | 1 | 8 | 1 | 83 | 519.618 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5-benzoxy-2-[[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazino]methyl]pyran-4-one](http://zinc12.docking.org/img/rings/96653.gif)