In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2008 | 28 | No |
Popular Name: (3S)-1-(3-chlorophenyl)-3-[4-(3-methoxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione (3S)-1-(3-chlorophenyl)-3-[4-(3-…
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) | 2.64 | 7.47 | -13.87 | 0 | 6 | 0 | 53 | 399.878 | 4 | ↓ |
Ref Reference (pH 7) | 2.64 | 7.76 | -12.68 | 0 | 6 | 0 | 53 | 399.878 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.64 | 9.92 | -55.5 | 1 | 6 | 1 | 54 | 400.886 | 4 | ↓ |