| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 21 | Yes |
Popular Name: (1S)-1-[3-bromo-4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)phenyl]-N-methyl-ethanamine (1S)-1-[3-bromo-4-([1,2,4]triazo…
| 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) | 4.07 | 10.16 | -52.87 | 2 | 4 | 1 | 47 | 364.292 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.07 | 8.99 | -12.85 | 1 | 4 | 0 | 42 | 363.284 | 4 | ↓ |
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)
![3-(phenylthio)-[1,2,4]triazolo[4,3-a]pyridine](http://zinc12.docking.org/img/rings/5031.gif)