| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 20 | Yes |
Popular Name: (1R,2S)-2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]cyclopentanecarbonitrile (1R,2S)-2-[2-(2,3-dihydro-1,4-be…
| 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) | 2.46 | 7.45 | -48.79 | 2 | 4 | 1 | 59 | 273.356 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.46 | 6.51 | -9.54 | 1 | 4 | 0 | 54 | 272.348 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Cyclopentyl-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]amine](http://zinc12.docking.org/img/rings/26428.gif)