In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2008 | 26 | No |
Popular Name: (3R)-4-[(3,5-dimethoxyphenyl)methyl]-3-(2-isoxazolidin-2-yl-2-oxo-ethyl)piperazin-2-one (3R)-4-[(3,5-dimethoxyphenyl)met…
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) | 1.67 | 3.84 | -43.95 | 2 | 8 | 1 | 82 | 364.422 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.86 | 1.36 | -42.56 | 1 | 8 | 0 | 88 | 363.414 | 6 | ↓ |