In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2010 | 33 | No |
Popular Name: 1-[dimethoxy(oxo)BLAHyl]-2-(2-hydroxyphenyl)ethane-1,2-dione 1-[dimethoxy(oxo)BLAHyl]-2-(2-hy…
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) | 2.44 | 7.47 | -14.63 | 1 | 8 | 0 | 96 | 450.491 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.44 | 8.48 | -58.26 | 0 | 8 | -1 | 99 | 449.483 | 4 | ↓ |