| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 9th, 2011 | 28 | Yes |
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) | 1.64 | 8.28 | -54.16 | 2 | 8 | 1 | 78 | 378.46 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 6.69 | -41.25 | 2 | 8 | 1 | 78 | 378.46 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 6.26 | -17.79 | 1 | 8 | 0 | 77 | 377.452 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 8.71 | -86.51 | 3 | 8 | 2 | 79 | 379.468 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine](http://zinc12.docking.org/img/rings/368088.gif)
![2-(1H-benzimidazol-2-yl)-5-(1H-imidazol-2-ylmethyl)-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine](http://zinc12.docking.org/img/rings/523715.gif)