| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2011 | 31 | No |
Popular Name: 2-[(E)-4-[[(1R)-1-[(2,3-dimethoxyphenyl)methyl]butyl]amino]but-2-enyl]isoindoline-1,3-dione 2-[(E)-4-[[(1R)-1-[(2,3-dimethox…
| 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) | 4.88 | 11.7 | -38.19 | 2 | 6 | 1 | 74 | 423.533 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.88 | 10.85 | -13.65 | 1 | 6 | 0 | 70 | 422.525 | 11 | ↓ |
![2-[4-(phenethylamino)but-2-enyl]isoindoline-1,3-quinone](http://zinc12.docking.org/img/rings/198564.gif)
