| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 22 | Yes |
| 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) | 0.99 | 5.14 | -14.42 | 0 | 6 | 0 | 53 | 317.418 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.99 | 5.59 | -31.82 | 1 | 6 | 1 | 54 | 318.426 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Thieno[3,2-d]pyrimidine](http://zinc12.docking.org/img/rings/4169.gif)
![1,2,3,4,6,7,8,9a-octahydropyrazino[1,2-a]pyrazin-9-one](http://zinc12.docking.org/img/rings/66563.gif)
![2-thieno[3,2-d]pyrimidin-4-yl-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-9-one](http://zinc12.docking.org/img/rings/416659.gif)