In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 27 | No |
Popular Name: (3S)-1-(4-chlorophenyl)-3-[4-(2-fluorophenyl)piperazin-1-yl]pyrrolidine-2,5-dione (3S)-1-(4-chlorophenyl)-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) | 2.75 | 8.73 | -10.79 | 0 | 5 | 0 | 44 | 387.842 | 3 | ↓ |
Ref Reference (pH 7) | 2.75 | 8.97 | -11.86 | 0 | 5 | 0 | 44 | 387.842 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 11.14 | -53.59 | 1 | 5 | 1 | 45 | 388.85 | 3 | ↓ |