| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2011 | 19 | Yes |
Popular Name: (1S,5R)-3-(6-chlorobenzothiophen-3-yl)-8-methyl-8-azabicyclo[3.2.1]oct-3-ene (1S,5R)-3-(6-chlorobenzothiophen…
| 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) | 4.26 | 10.76 | -37.47 | 1 | 1 | 1 | 4 | 290.839 | 1 | ↓ |
| Hi High (pH 8-9.5) | 4.26 | 8.38 | -2.56 | 0 | 1 | 0 | 3 | 289.831 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![8-azabicyclo[3.2.1]oct-2-ene](http://zinc12.docking.org/img/rings/198143.gif)
![3-(benzothiophen-3-yl)-8-azabicyclo[3.2.1]oct-2-ene](http://zinc12.docking.org/img/rings/198154.gif)