| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2011 | 32 | No |
| 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) | 4.83 | 7.23 | -20.06 | 3 | 7 | 0 | 112 | 465.556 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.29 | 5.88 | -49.24 | 2 | 7 | -1 | 115 | 464.548 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.29 | 6.65 | -95.21 | 1 | 7 | -2 | 118 | 463.54 | 6 | ↓ |
![1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/13361.gif)
![2-[(4-keto-5-phenyl-1H-thieno[2,3-d]pyrimidin-2-yl)thio]-N-phenyl-acetamide](http://zinc12.docking.org/img/rings/18271.gif)
