| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 28 | No |
| 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) | 0.71 | 4.29 | -14.93 | 3 | 9 | 0 | 114 | 395.448 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,4,8,8a-tetrahydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one](http://zinc12.docking.org/img/rings/591943.gif)
![4-phenyl-1-(5H-purin-6-yl)-2,4,8,8a-tetrahydropyrazolo[3,4-e][1,4]thiazepin-7-one](http://zinc12.docking.org/img/rings/591942.gif)