| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 21 | Yes |
Popular Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[(2-chloro-6-fluoro-phenyl)met…
| 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) | 4.78 | 7.68 | -16.61 | 1 | 3 | 0 | 46 | 340.832 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.24 | 6.24 | -52.76 | 0 | 3 | -1 | 49 | 339.824 | 3 | ↓ |
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-(benzylthio)-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/28341.gif)