| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 18 | No |
Popular Name: 3-[(2S)-2,3-dihydroxypropyl]-6-ethyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one 3-[(2S)-2,3-dihydroxypropyl]-6-e…
| 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) | 0.32 | 1.48 | -12.15 | 3 | 5 | 0 | 78 | 286.378 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.77 | 0.2 | -39.75 | 2 | 5 | -1 | 81 | 285.37 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/28218.gif)