| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 35 | Yes |
Popular Name: 3-(2-ethoxyphenoxy)-7-hydroxy-8-[[4-(2-pyridyl)piperazin-1-yl]methyl]chromen-4-one 3-(2-ethoxyphenoxy)-7-hydroxy-8-…
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| 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) | 4.07 | 9.58 | -43.05 | 2 | 8 | 1 | 90 | 474.537 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.07 | 10.01 | -47.93 | 0 | 8 | -1 | 91 | 472.521 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.07 | 9.25 | -17.59 | 1 | 8 | 0 | 88 | 473.529 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.07 | 11.48 | -55.17 | 2 | 8 | 1 | 89 | 474.537 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.07 | 11.8 | -113.2 | 3 | 8 | 2 | 91 | 475.545 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-phenoxy-8-[[4-(2-pyridyl)piperazino]methyl]chromone](http://zinc12.docking.org/img/rings/550409.gif)