| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2011 | 34 | Yes |
Popular Name: benzyl benzyl
| 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) | 5.22 | 7.82 | -19.62 | 3 | 8 | 0 | 121 | 495.582 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.68 | 6.61 | -43.66 | 2 | 8 | -1 | 124 | 494.574 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/13361.gif)
![2-[(2-anilino-2-keto-ethyl)thio]-4-keto-1H-thieno[2,3-d]pyrimidine-6-carboxylic Acid Benzyl Ester](http://zinc12.docking.org/img/rings/18280.gif)