In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 2006 | 31 | No |
Popular Name: 1-benzyl-5-(4-ethylphenyl)-4-[(4-fluorophenyl)-hydroxy-methylene]-pyrrolidine-2,3-dione 1-benzyl-5-(4-ethylphenyl)-4-[(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) | 4.85 | 12.97 | -53.04 | 0 | 4 | -1 | 60 | 414.456 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.86 | 1.77 | -9.59 | 1 | 4 | 0 | 57 | 415.464 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.27 | 1.63 | -10.25 | 0 | 4 | 0 | 54 | 415.464 | 6 | ↓ |