| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 34 | Yes |
| 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) | 2.05 | 7.3 | -60.8 | 3 | 9 | 1 | 109 | 493.65 | 12 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 5.05 | -17.31 | 2 | 9 | 0 | 108 | 492.642 | 12 | ↓ |
| Hi High (pH 8-9.5) | 2.51 | 4.67 | -52.04 | 2 | 9 | 0 | 112 | 492.642 | 12 | ↓ |
| Lo Low (pH 4.5-6) | 2.05 | 7.32 | -56.1 | 3 | 9 | 1 | 109 | 493.65 | 12 | ↓ |
![5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/3359.gif)
![2-[(2-morpholinoethylamino)methyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/73012.gif)
