| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 27 | Yes |
Popular Name: 2-[[4-(2,2-difluoroethyl)piperazin-1-yl]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one 2-[[4-(2,2-difluoroethyl)piperaz…
| 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) | 2.84 | 6.38 | -14.19 | 1 | 5 | 0 | 52 | 390.459 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.84 | 8.62 | -53.19 | 2 | 5 | 1 | 53 | 391.467 | 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-phenyl-2-(piperazinomethyl)-3H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/43142.gif)