In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2011 | 21 | Yes |
Popular Name: 1-[3-(benzenesulfonylmethyl)-5-fluoro-2-hydroxy-phenyl]ethanone 1-[3-(benzenesulfonylmethyl)-5-f…
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) | 2.10 | 5.11 | -17.61 | 1 | 4 | 0 | 71 | 308.33 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.10 | 6.04 | -55.23 | 0 | 4 | -1 | 74 | 307.322 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.