| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 20 | No |
Popular Name: 3-(1-propyl-4-piperidyl)-2-sulfanyl-thieno[2,3-d]pyrimidin-4-one 3-(1-propyl-4-piperidyl)-2-sulfa…
| 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) | 2.10 | 8.84 | -36.39 | 2 | 4 | 1 | 42 | 310.468 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 7.75 | -41.06 | 1 | 4 | 0 | 45 | 309.46 | 3 | ↓ |
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-(4-piperidyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/28287.gif)