| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | No |
Popular Name: 2-(chloromethyl)-5-(4-ethylphenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one 2-(chloromethyl)-5-(4-ethylpheny…
| 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) | 4.28 | 9.14 | -12.68 | 1 | 3 | 0 | 46 | 318.829 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.74 | 6.9 | -46.07 | 0 | 3 | -1 | 49 | 317.821 | 3 | ↓ |
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-phenyl-3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/24418.gif)