| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(5-chloro-2-thienyl)-N-[(1R)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]ethanamine (1S)-1-(5-chloro-2-thienyl)-N-[(…
| 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) | 3.65 | 8.96 | -44.79 | 2 | 4 | 1 | 47 | 307.83 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.65 | 8.1 | -13.41 | 1 | 4 | 0 | 42 | 306.822 | 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)
![2-thenyl([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)amine](http://zinc12.docking.org/img/rings/92302.gif)