| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 22 | No |
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) | 1.25 | 3.22 | -9.75 | 1 | 6 | 0 | 69 | 317.37 | 1 | ↓ |
| Ref Reference (pH 7) | 1.06 | 5.58 | -9.8 | 1 | 6 | 0 | 65 | 317.37 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine](http://zinc12.docking.org/img/rings/2076.gif)
![4-(2,3-dihydro-1,4-benzodioxin-7-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine](http://zinc12.docking.org/img/rings/582568.gif)