| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 30 | 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) | -2.35 | 2.02 | -108.77 | 4 | 13 | 0 | 187 | 469.534 | 8 | ↓ |
| Mid Mid (pH 6-8) | -2.35 | 1.62 | -82.29 | 3 | 13 | -1 | 185 | 468.526 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one](http://zinc12.docking.org/img/rings/13223.gif)
![N-[8-keto-3-[(1,3,4-thiadiazol-2-ylthio)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-2-(tetrazol-1-yl)acetamide](http://zinc12.docking.org/img/rings/197312.gif)