| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 25 | Yes |
Popular Name: 2-[[(3S)-3-methyl-4-([1,2,4]triazolo[3,4-f]pyridazin-6-yl)piperazin-1-yl]methyl]benzonitrile 2-[[(3S)-3-methyl-4-([1,2,4]tria…
| 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) | 1.81 | 9.88 | -16.13 | 0 | 7 | 0 | 73 | 333.399 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 12.09 | -56.74 | 1 | 7 | 1 | 75 | 334.407 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[1,2,4]triazolo[3,4-f]pyridazine](http://zinc12.docking.org/img/rings/6317.gif)
![6-(4-benzylpiperazino)-[1,2,4]triazolo[3,4-f]pyridazine](http://zinc12.docking.org/img/rings/338412.gif)