In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 20 | No |
Popular Name: (E)-3-[2-fluoro-5-[(1-methylimidazol-2-yl)sulfanylmethyl]phenyl]prop-2-enoic (E)-3-[2-fluoro-5-[(1-methylimid…
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) | 2.39 | 9.87 | -54.67 | 0 | 4 | -1 | 58 | 291.327 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.39 | 10.35 | -69.49 | 1 | 4 | 0 | 59 | 292.335 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.