| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 18 | Yes |
Popular Name: (2S)-2-[2-(5-isobutyl-2-methyl-1,2,4-triazol-3-yl)ethyl]piperidine (2S)-2-[2-(5-isobutyl-2-methyl-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) | 2.10 | 7.66 | -45.37 | 2 | 4 | 1 | 47 | 251.398 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.10 | 8.44 | -102.79 | 3 | 4 | 2 | 49 | 252.406 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[2-(1H-1,2,4-triazol-5-yl)ethyl]piperidine](http://zinc12.docking.org/img/rings/143345.gif)