| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2011 | 22 | No |
Popular Name: 1-[1-[[5-(dimethylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-4-piperidyl]pyrrolidin-2-one 1-[1-[[5-(dimethylamino)-2-thiox…
None
None
| 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) | 0.77 | 9.2 | -40.97 | 1 | 6 | 1 | 46 | 342.514 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 6.84 | -18.19 | 0 | 6 | 0 | 45 | 341.506 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1-[1-[(2-thioxo-1,3,4-thiadiazol-3-yl)methyl]-4-piperidyl]-2-pyrrolidone](http://zinc12.docking.org/img/rings/298665.gif)