| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 31 | No |
Popular Name: (2Z)-2-benzylidene-6-hydroxy-7-[[(2S)-2-(3-pyridyl)-1-piperidyl]methyl]benzofuran-3-one (2Z)-2-benzylidene-6-hydroxy-7-[…
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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) | 4.18 | 11.13 | -39.69 | 2 | 5 | 1 | 68 | 413.497 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.18 | 9.91 | -46.1 | 0 | 5 | -1 | 69 | 411.481 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.18 | 11.91 | -33.78 | 1 | 5 | 0 | 71 | 412.489 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.18 | 9.14 | -8.76 | 1 | 5 | 0 | 67 | 412.489 | 4 | ↓ |
![2-benzal-7-[[2-(3-pyridyl)piperidino]methyl]coumaran-3-one](http://zinc12.docking.org/img/rings/325143.gif)
