| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 19 | No |
Popular Name: 2-(chloromethyl)-5-(5-ethyl-2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one 2-(chloromethyl)-5-(5-ethyl-2-th…
| 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) | 3.73 | 7.73 | -13.19 | 1 | 3 | 0 | 46 | 310.831 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.18 | 5.56 | -44.06 | 0 | 3 | -1 | 49 | 309.823 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/3143.gif)
![5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/38173.gif)