| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 24 | Yes |
Popular Name: 2-[4-(4-chlorophenoxy)butylsulfanyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[4-(4-chlorophenoxy)butylsulfa…
| 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) | 5.34 | 8.9 | -18.05 | 1 | 4 | 0 | 55 | 380.922 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.80 | 7.43 | -49.08 | 0 | 4 | -1 | 58 | 379.914 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/13361.gif)
![2-(4-phenoxybutylthio)-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/28352.gif)