In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 21 | Yes |
Popular Name: 3-[(2-ethylimidazol-1-yl)methyl]-4-fluoro-benzothiophene-2-carboxylic 3-[(2-ethylimidazol-1-yl)methyl]…
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) | 3.07 | 10.14 | -39.42 | 1 | 4 | 0 | 59 | 304.346 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.07 | 9.67 | -50.62 | 0 | 4 | -1 | 58 | 303.338 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.