| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 17 | No |
Popular Name: 3-[(1S)-2-cyclopropyl-1-methyl-ethyl]-2-sulfanyl-thieno[2,3-d]pyrimidin-4-one 3-[(1S)-2-cyclopropyl-1-methyl-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) | 2.30 | 8.11 | -9.83 | 1 | 3 | 0 | 38 | 266.391 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 7.06 | -37.16 | 0 | 3 | -1 | 41 | 265.383 | 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-cyclopropylethyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/522461.gif)