In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2006 | 27 | No |
Popular Name: 5-(3,4-dimethoxyphenyl)-4-[hydroxy-(3-methoxyphenyl)-methylene]-pyrrolidine-2,3-dione 5-(3,4-dimethoxyphenyl)-4-[hydro…
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) | 1.81 | 3.54 | -62.07 | 1 | 7 | -1 | 97 | 368.365 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.26 | -1.7 | -20.2 | 2 | 7 | 0 | 94 | 369.373 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.23 | -1.61 | -26.19 | 1 | 7 | 0 | 90 | 369.373 | 6 | ↓ |