| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 21 | Yes |
Popular Name: 5-isobutyl-2-(6-methyl-2-pyridyl)-3H-thieno[2,3-d]pyrimidin-4-one 5-isobutyl-2-(6-methyl-2-pyridyl…
| 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) | 3.00 | 6.89 | -14.81 | 1 | 4 | 0 | 59 | 299.399 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.45 | 5.46 | -53.02 | 0 | 4 | -1 | 62 | 298.391 | 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-(2-pyridyl)-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/152028.gif)