| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2008 | 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) | 2.84 | 9.46 | -18.54 | 1 | 7 | 0 | 92 | 446.529 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.02 | 8.62 | -50.54 | 0 | 7 | -1 | 99 | 445.521 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-2-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetamide](http://zinc12.docking.org/img/rings/105767.gif)