| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 18 | No |
Popular Name: 6-ethyl-3-(3-oxobutyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one 6-ethyl-3-(3-oxobutyl)-2-thioxo-…
| 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) | 1.41 | 7.49 | -12.32 | 1 | 4 | 0 | 55 | 282.39 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 6.21 | -39.61 | 0 | 4 | -1 | 58 | 281.382 | 4 | ↓ |
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)