| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 24 | Yes |
Popular Name: 2-[[(2S)-2-(1,2,4-triazol-1-ylmethyl)-1-piperidyl]methyl]indolizine-1-carbonitrile 2-[[(2S)-2-(1,2,4-triazol-1-ylme…
| 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) | 1.49 | 12.99 | -49.66 | 1 | 6 | 1 | 63 | 321.408 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 10.86 | -17.18 | 0 | 6 | 0 | 62 | 320.4 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[[2-(1,2,4-triazol-1-ylmethyl)piperidino]methyl]indolizine](http://zinc12.docking.org/img/rings/407567.gif)