| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 20 | No |
Popular Name: 2-[2-[[(3S)-1,1-dioxothiolan-3-yl]amino]ethyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one 2-[2-[[(3S)-1,1-dioxothiolan-3-y…
| 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) | -0.22 | 3.3 | -63.47 | 2 | 7 | 1 | 90 | 297.36 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.22 | 2.15 | -20.81 | 1 | 7 | 0 | 85 | 296.352 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2H-[1,2,4]triazolo[4,3-a]pyridin-3-one](http://zinc12.docking.org/img/rings/35422.gif)
![2-[2-[(1,1-diketothiolan-3-yl)amino]ethyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one](http://zinc12.docking.org/img/rings/72758.gif)