| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 22 | No |
Popular Name: 5-(2-furyl)-2-[(1S)-1-isobutylsulfanylethyl]-3H-thieno[2,3-d]pyrimidin-4-one 5-(2-furyl)-2-[(1S)-1-isobutylsu…
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| 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) | 3.69 | 9.55 | -13.36 | 1 | 4 | 0 | 59 | 334.466 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.15 | 7.46 | -52.19 | 0 | 4 | -1 | 62 | 333.458 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/3143.gif)
![5-(2-furyl)-3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/6295.gif)