| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 31 | Yes |
Popular Name: [[4-ethyl-5-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]-1,2,4-triazol-3-yl]thio]methylBLAH [[4-ethyl-5-[2-methyl-5-(trifluo…
| 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) | 1.75 | 9.88 | -13.44 | 1 | 11 | 0 | 120 | 449.426 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 9.84 | -20.09 | 1 | 11 | 0 | 120 | 449.426 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![[[5-(1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl]thio]methylBLAH](http://zinc12.docking.org/img/rings/242989.gif)