| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 10th, 2011 | 30 | Yes |
Popular Name: N-(1-benzyl-4-piperidyl)-N'-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butanediamide N-(1-benzyl-4-piperidyl)-N'-([1,…
| 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) | 1.91 | 11.35 | -48.53 | 3 | 8 | 1 | 96 | 407.498 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 10.91 | -84.89 | 2 | 8 | 0 | 99 | 406.49 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 8.67 | -61.62 | 1 | 8 | -1 | 98 | 405.482 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2H-[1,2,4]triazolo[4,3-a]pyridin-3-ylideneamine](http://zinc12.docking.org/img/rings/153815.gif)
![N-(1-benzyl-4-piperidyl)-N'-(2H-[1,2,4]triazolo[4,3-a]pyridin-3-ylidene)succinamide](http://zinc12.docking.org/img/rings/386415.gif)