In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2006 | 30 | No |
Popular Name: 1-benzyl-4-[(4-fluorophenyl)-hydroxy-methylene]-5-(4-hydroxyphenyl)-pyrrolidine-2,3-dione 1-benzyl-4-[(4-fluorophenyl)-hyd…
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) | 3.46 | 8.78 | -57.59 | 1 | 5 | -1 | 81 | 402.401 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.88 | 8.99 | -11.85 | 1 | 5 | 0 | 75 | 403.409 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 8.65 | -12 | 2 | 5 | 0 | 78 | 403.409 | 5 | ↓ |