In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2006 | 32 | No |
Popular Name: 5-(2-chlorophenyl)-4-[hydroxy-(4-methoxyphenyl)-methylene]-1-phenethyl-pyrrolidine-2,3-dione 5-(2-chlorophenyl)-4-[hydroxy-(4…
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) | 4.87 | 12.2 | -52.28 | 0 | 5 | -1 | 70 | 446.91 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.87 | 1.33 | -13.52 | 1 | 5 | 0 | 66 | 447.918 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.29 | 1.19 | -23.78 | 0 | 5 | 0 | 63 | 447.918 | 7 | ↓ |