| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 20 | Yes |
Popular Name: (2S)-1-piperazin-1-yl-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)propan-1-one (2S)-1-piperazin-1-yl-2-([1,2,4]…
| 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) | 0.69 | 6.56 | -56.09 | 2 | 6 | 1 | 67 | 292.388 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.69 | 5.27 | -14.06 | 1 | 6 | 0 | 63 | 291.38 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[1,2,4]triazolo[4,3-a]pyridine](http://zinc12.docking.org/img/rings/2142.gif)
![1-piperazino-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)ethanone](http://zinc12.docking.org/img/rings/214253.gif)