In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2006 | 25 | No |
Popular Name: 1-allyl-4-[(4-bromophenyl)-hydroxy-methylene]-5-phenyl-pyrrolidine-2,3-dione 1-allyl-4-[(4-bromophenyl)-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) | 3.83 | 9.35 | -56.18 | 0 | 4 | -1 | 60 | 397.248 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 0.54 | -17.71 | 1 | 4 | 0 | 57 | 398.256 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.25 | -0.14 | -9.05 | 0 | 4 | 0 | 54 | 398.256 | 5 | ↓ |