| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 20 | Yes |
Popular Name: (2S)-2-(cyclopropylamino)-2-methyl-3-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)propanoic (2S)-2-(cyclopropylamino)-2-meth…
| 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) | -0.47 | 8.43 | -40.71 | 2 | 6 | 0 | 87 | 292.364 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.47 | 7.37 | -58.23 | 1 | 6 | -1 | 82 | 291.356 | 6 | ↓ |
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)
![Cyclopropyl-[2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)ethyl]amine](http://zinc12.docking.org/img/rings/214243.gif)