In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2006 | 30 | No |
Popular Name: 1-benzyl-4-[(4-fluorophenyl)-hydroxy-methylene]-5-(3-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) | 3.44 | 8.3 | -37.81 | 1 | 5 | -1 | 81 | 402.401 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.85 | 8.73 | -21.63 | 1 | 5 | 0 | 75 | 403.409 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.44 | 7.17 | -17.65 | 2 | 5 | 0 | 78 | 403.409 | 5 | ↓ |