In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2008 | 29 | No |
Popular Name: (3R)-1-(4-ethoxyphenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]pyrrolidine-2,5-dione (3R)-1-(4-ethoxyphenyl)-3-[4-(2-…
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) | 2.50 | 8.69 | -11.85 | 0 | 6 | 0 | 53 | 397.45 | 5 | ↓ |
Ref Reference (pH 7) | 2.50 | 8.68 | -13.49 | 0 | 6 | 0 | 53 | 397.45 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.51 | 10.83 | -49.17 | 1 | 6 | 1 | 54 | 398.458 | 5 | ↓ |