| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 11th, 2011 | 18 | No |
Popular Name: (2S)-6-butyl-5-chloro-2,3-dimethyl-2H-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (2S)-6-butyl-5-chloro-2,3-dimeth…
| 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) | 3.88 | 6.51 | -9.18 | 0 | 4 | 0 | 44 | 264.76 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.88 | 7.5 | -28.32 | 1 | 4 | 1 | 46 | 265.768 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3-dihydro-[1,2,4]triazolo[1,5-a]pyridine](http://zinc12.docking.org/img/rings/195860.gif)