| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 14 | 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) | -0.36 | 2.68 | -47.89 | 2 | 4 | 1 | 51 | 197.258 | 0 | ↓ |
| Hi High (pH 8-9.5) | -0.36 | 0.28 | -8.84 | 1 | 4 | 0 | 49 | 196.25 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3,9-diazaspiro[5.5]undecane-2,4-quinone](http://zinc12.docking.org/img/rings/48001.gif)