In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2006 | 31 | No |
Popular Name: 4-[(4-fluorophenyl)-hydroxy-methylene]-5-(3-hydroxyphenyl)-1-phenethyl-pyrrolidine-2,3-dione 4-[(4-fluorophenyl)-hydroxy-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) | 3.84 | 10.24 | -54.88 | 1 | 5 | -1 | 81 | 416.428 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.84 | 9.11 | -12.72 | 2 | 5 | 0 | 78 | 417.436 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.26 | 9.42 | -12.65 | 1 | 5 | 0 | 75 | 417.436 | 6 | ↓ |