| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 33 | Yes |
Popular Name: 3-(2-bromophenoxy)-7-hydroxy-8-[[(2S)-2-(3-pyridyl)-1-piperidyl]methyl]chromen-4-one 3-(2-bromophenoxy)-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) | 5.21 | 11.53 | -48.18 | 2 | 6 | 1 | 77 | 508.392 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.21 | 9.64 | -12.98 | 1 | 6 | 0 | 76 | 507.384 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.21 | 12.3 | -41.59 | 1 | 6 | 0 | 80 | 507.384 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-phenoxy-8-[[2-(3-pyridyl)piperidino]methyl]chromone](http://zinc12.docking.org/img/rings/549878.gif)