| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2010 | 20 | No |
Popular Name: 3-[[4-(5-bromo-2-pyridyl)piperazin-1-yl]methyl]-1,3,4-thiadiazole-2-thione 3-[[4-(5-bromo-2-pyridyl)piperaz…
| 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) | 2.07 | 6.37 | -12.71 | 0 | 5 | 0 | 37 | 372.317 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.07 | 8.7 | -44.32 | 1 | 5 | 1 | 38 | 373.325 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[[4-(2-pyridyl)piperazino]methyl]-1,3,4-thiadiazole-2-thione](http://zinc12.docking.org/img/rings/123474.gif)