| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 26 | No |
None
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) | 1.22 | 10.47 | -63.21 | 1 | 7 | 1 | 52 | 377.538 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.22 | 8.81 | -27.88 | 0 | 7 | 0 | 51 | 376.53 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.22 | 10.84 | -72.73 | 1 | 7 | 1 | 52 | 377.538 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 12.52 | -137.64 | 2 | 7 | 2 | 53 | 378.546 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione](http://zinc12.docking.org/img/rings/123206.gif)
![1-[[3-(morpholinomethyl)piperidino]methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione](http://zinc12.docking.org/img/rings/460799.gif)