| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2008 | 33 | 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) | 2.99 | 12.92 | -14.4 | 0 | 8 | 0 | 76 | 480.619 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 15.2 | -54.19 | 1 | 8 | 1 | 77 | 481.627 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4H-[1,2,4]triazolo[4,3-a]quinazolin-5-one](http://zinc12.docking.org/img/rings/2049.gif)
![1-[[2-keto-2-[4-(2-thenyl)piperazino]ethyl]thio]-4H-[1,2,4]triazolo[4,3-a]quinazolin-5-one](http://zinc12.docking.org/img/rings/104601.gif)