| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 28 | 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) | 0.84 | 2.72 | -83.3 | 2 | 9 | 0 | 109 | 382.424 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.84 | 0.49 | -56.18 | 1 | 9 | -1 | 108 | 381.416 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.84 | 1.99 | -55.34 | 3 | 9 | 1 | 106 | 383.432 | 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)
![N-[2-(1-ketophthalazin-2-yl)ethyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide](http://zinc12.docking.org/img/rings/406262.gif)