| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 35 | Yes |
Popular Name: 7-hydroxy-3-phenyl-8-[[4-(2-pyridyl)piperazin-1-yl]methyl]-2-(trifluoromethyl)chromen-4-one 7-hydroxy-3-phenyl-8-[[4-(2-pyri…
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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) | 5.06 | 9.82 | -34.73 | 2 | 6 | 1 | 71 | 482.482 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.06 | 10.24 | -40.22 | 0 | 6 | -1 | 73 | 480.466 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.06 | 9.48 | -10.26 | 1 | 6 | 0 | 70 | 481.474 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.06 | 11.7 | -48.69 | 2 | 6 | 1 | 71 | 482.482 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.06 | 12.04 | -105 | 3 | 6 | 2 | 72 | 483.49 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-phenyl-8-[[4-(2-pyridyl)piperazino]methyl]chromone](http://zinc12.docking.org/img/rings/550397.gif)