In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 22 | No |
Popular Name: (3R)-1-(2,3-dichlorophenyl)-3-(4-methylpiperazin-1-yl)pyrrolidine-2,5-dione (3R)-1-(2,3-dichlorophenyl)-3-(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) | 1.52 | 6.74 | -45.64 | 1 | 5 | 1 | 45 | 343.234 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 4.34 | -12.01 | 0 | 5 | 0 | 44 | 342.226 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 6.83 | -48.57 | 1 | 5 | 1 | 45 | 343.234 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 4.36 | -11.16 | 0 | 5 | 0 | 44 | 342.226 | 2 | ↓ |