| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2010 | 20 | No |
Popular Name: [4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-1-yl]-(1,2,5-thiadiazol-3-yl)methanone [4-[(3S)-1,1-dioxothiolan-3-yl]p…
| 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) | -0.38 | -0.98 | -14.93 | 0 | 7 | 0 | 83 | 316.408 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.38 | 1.17 | -61.83 | 1 | 7 | 1 | 85 | 317.416 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[4-(1,1-diketothiolan-3-yl)piperazino]-(1,2,5-thiadiazol-3-yl)methanone](http://zinc12.docking.org/img/rings/569900.gif)