In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 26 | No |
Popular Name: (3S)-1-(2,4-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]pyrrolidine-2,5-dione (3S)-1-(2,4-dimethoxyphenyl)-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) | -0.33 | -0.72 | -16.43 | 1 | 8 | 0 | 83 | 363.414 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.33 | 1.63 | -44.78 | 2 | 8 | 1 | 84 | 364.422 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.33 | 1.9 | -47.34 | 2 | 8 | 1 | 84 | 364.422 | 6 | ↓ |