| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 24 | No |
Popular Name: 3-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]pentane-2,4-dione 3-[(4-oxo-5-phenyl-3H-thieno[2,3…
| 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) | 3.02 | 7.96 | -16.51 | 1 | 5 | 0 | 80 | 358.444 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.78 | 7.96 | -38.16 | 1 | 5 | -1 | 86 | 357.436 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 6.85 | -52.61 | 0 | 5 | -1 | 83 | 357.436 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.24 | 6.84 | -107.49 | 0 | 5 | -2 | 89 | 356.428 | 4 | ↓ |
![3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/3143.gif)
![5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/24418.gif)
