| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 20 | Yes |
Popular Name: (1S)-1-(2-thienyl)-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethyl]ethanamine (1S)-1-(2-thienyl)-N-[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) | 3.33 | 9.61 | -48.02 | 2 | 4 | 1 | 47 | 305.452 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 8.39 | -13.39 | 1 | 4 | 0 | 42 | 304.444 | 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)
![2-thenyl-[2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)ethyl]amine](http://zinc12.docking.org/img/rings/214300.gif)