| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 22 | No |
Popular Name: 2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]-4-methyl-1,2,4-triazole-3-thione 2-[[4-(2,3-dimethylphenyl)pipera…
| 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) | 1.92 | 11.04 | -14.32 | 0 | 5 | 0 | 29 | 317.462 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 11.03 | -40.92 | 1 | 5 | 1 | 30 | 318.47 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(4-phenylpiperazino)methyl]-4H-1,2,4-triazole-3-thione](http://zinc12.docking.org/img/rings/67225.gif)