In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 19 | No |
Popular Name: 1-[1-[(1-ethylimidazol-2-yl)methyl]triazol-4-yl]-2,2,2-trifluoro-ethanone 1-[1-[(1-ethylimidazol-2-yl)meth…
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) | 0.67 | 5.31 | -42.29 | 1 | 6 | 1 | 67 | 274.226 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 4.95 | -11.58 | 0 | 6 | 0 | 66 | 273.218 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.