In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2006 | 25 | No |
Popular Name: 4-[hydroxy-(2-thienyl)methylene]-1-(2-methoxyethyl)-5-(p-tolyl)pyrrolidine-2,3-dione 4-[hydroxy-(2-thienyl)methylene]…
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) | 2.71 | 7.03 | -63.97 | 0 | 5 | -1 | 70 | 356.423 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.16 | 0.39 | -17.35 | 1 | 5 | 0 | 66 | 357.431 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.13 | -0.52 | -9.52 | 0 | 5 | 0 | 63 | 357.431 | 6 | ↓ |