In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2007 | 29 | No |
Popular Name: 5-(3-fluorophenyl)-1-hexyl-4-[hydroxy-(p-tolyl)methylene]-pyrrolidine-2,3-dione 5-(3-fluorophenyl)-1-hexyl-4-[hy…
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) | 5.41 | 11.88 | -63.34 | 0 | 4 | -1 | 60 | 394.466 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.83 | 12.64 | -11.33 | 0 | 4 | 0 | 54 | 395.474 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.86 | 11.75 | -20.94 | 1 | 4 | 0 | 58 | 395.474 | 7 | ↓ |