| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2011 | 30 | 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) | 4.54 | 6.11 | -17.95 | 3 | 7 | 0 | 112 | 443.55 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.99 | 5.52 | -94.12 | 1 | 7 | -2 | 118 | 441.534 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.54 | 6.88 | -48.07 | 2 | 7 | -1 | 115 | 442.542 | 5 | ↓ |
![5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/18273.gif)
![2-[(4-keto-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-2-yl)thio]-N-phenyl-acetamide](http://zinc12.docking.org/img/rings/18272.gif)
