| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 20 | Yes |
Popular Name: 3-[2-(2-pyridylmethylamino)ethyl]thieno[3,2-d]pyrimidin-4-one 3-[2-(2-pyridylmethylamino)ethyl…
| 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) | 0.83 | 6.47 | -52.04 | 2 | 5 | 1 | 64 | 287.368 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | 5.1 | -14.54 | 1 | 5 | 0 | 60 | 286.36 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3H-thieno[3,2-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/4166.gif)
![3-[2-(2-pyridylmethylamino)ethyl]thieno[3,2-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/74060.gif)