| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 23 | Yes |
Popular Name: 6-methyl-2-(4-phenoxybutylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one 6-methyl-2-(4-phenoxybutylsulfan…
| 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) | 4.66 | 8.38 | -18.42 | 1 | 4 | 0 | 55 | 346.477 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.12 | 6.91 | -50.18 | 0 | 4 | -1 | 58 | 345.469 | 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)