| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2011 | 33 | 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) | 4.56 | 10.21 | -47.06 | 1 | 7 | -1 | 110 | 510.671 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.02 | 8.85 | -101.39 | 0 | 7 | -2 | 113 | 509.663 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/18273.gif)
![2-[2-[(3-phenyl-2-thioxo-4-thiazolin-4-yl)imino]ethylthio]-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/375687.gif)