| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 38 | No |
| 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) | 1.25 | 10.03 | -124.24 | 3 | 7 | 2 | 83 | 539.721 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 10.51 | -211.76 | 4 | 7 | 3 | 84 | 540.729 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![8-azabicyclo[3.2.1]octane](http://zinc12.docking.org/img/rings/53.gif)
![3H-imidazo[4,5-c]pyridine](http://zinc12.docking.org/img/rings/47978.gif)
![N-[3-(3-imidazo[4,5-c]pyridin-3-yl-8-azabicyclo[3.2.1]octan-8-yl)-1-phenyl-propyl]-1-keto-thiane-4-carboxamide](http://zinc12.docking.org/img/rings/365943.gif)