| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 19 | No |
Popular Name: 3-[(1R)-2-imidazol-1-yl-1-methyl-ethyl]-2-sulfanyl-thieno[2,3-d]pyrimidin-4-one 3-[(1R)-2-imidazol-1-yl-1-methyl…
| 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) | 0.84 | 8.91 | -31.59 | 2 | 5 | 1 | 57 | 293.397 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.30 | 7.31 | -38.75 | 0 | 5 | -1 | 59 | 291.381 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.84 | 8.4 | -13.02 | 1 | 5 | 0 | 56 | 292.389 | 3 | ↓ |
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)
![3-(2-imidazol-1-ylethyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/544867.gif)