| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 10th, 2009 | 29 | Yes |
Popular Name: 2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-5-(2-thienyl)-3H-thieno[3,2-e]pyrimidin-4-one 2-[[4-(2-hydroxyphenyl)piperazin…
None
| 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) | 3.48 | 7.12 | -79.23 | 3 | 6 | 1 | 74 | 425.559 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 5.66 | -16.74 | 2 | 6 | 0 | 72 | 424.551 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.94 | 6.89 | -46.61 | 2 | 6 | 0 | 77 | 424.551 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 8.85 | -55.34 | 3 | 6 | 1 | 74 | 425.559 | 4 | ↓ |
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-[(4-phenylpiperazino)methyl]-5-(2-thienyl)-1H-thieno[2,3-d]pyrimidin-4-one](http://zinc12.docking.org/img/rings/143654.gif)