| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2011 | 24 | Yes |
Popular Name: 2-[(dipropylamino)methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[(dipropylamino)methyl]-6-phen…
| 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) | 4.33 | 11 | -49.76 | 2 | 4 | 1 | 50 | 342.488 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.79 | 8.54 | -45.16 | 1 | 4 | 0 | 53 | 341.48 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.33 | 8.85 | -10.47 | 1 | 4 | 0 | 49 | 341.48 | 7 | ↓ |
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)
![6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/44334.gif)