| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2010 | 25 | Yes |
Popular Name: 2-[[4-ethyl-5-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone 2-[[4-ethyl-5-(m-tolyl)-1,2,4-tr…
| 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) | 2.54 | 10.98 | -48.56 | 1 | 6 | 1 | 55 | 360.507 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 8.62 | -12.46 | 0 | 6 | 0 | 54 | 359.499 | 5 | ↓ |
![2-[(5-phenyl-4H-1,2,4-triazol-3-yl)thio]-1-piperazino-ethanone](http://zinc12.docking.org/img/rings/36660.gif)
