| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 25 | Yes |
| 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) | 1.92 | 7.79 | -49.16 | 1 | 5 | 1 | 37 | 348.511 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 5.94 | -10.66 | 0 | 5 | 0 | 36 | 347.503 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Bicyclo[2.2.1]hept-2-ene](http://zinc12.docking.org/img/rings/1252.gif)
![1,4,9-triazaspiro[5.5]undecane](http://zinc12.docking.org/img/rings/518796.gif)
![2-(5-bicyclo[2.2.1]hept-2-enylmethyl)-2,5,9-triazaspiro[5.5]undecane](http://zinc12.docking.org/img/rings/610425.gif)