In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2007 | 18 | No |
Popular Name: 5-Benzofuran-2-yl-4-isopropyl-4H-[1,2,4]triazole-3-thiol 5-Benzofuran-2-yl-4-isopropyl-4H…
None
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) | 2.75 | 8.59 | -8.65 | 1 | 4 | 0 | 47 | 259.334 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.48 | 8.69 | -44.11 | 0 | 4 | -1 | 44 | 258.326 | 2 | ↓ |