| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 19 | No |
Popular Name: 3-(1,1-dioxothian-4-yl)-2-sulfanyl-thieno[2,3-d]pyrimidin-4-one 3-(1,1-dioxothian-4-yl)-2-sulfan…
| 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) | 0.59 | 3.61 | -18 | 1 | 5 | 0 | 72 | 316.429 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 2.52 | -40.06 | 0 | 5 | -1 | 75 | 315.421 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/28218.gif)
![3-(1,1-diketothian-4-yl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/90024.gif)