In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2010 | 30 | No |
Popular Name: 3-[3,4-dihydroxy-2-[2-(2-methoxyethoxy)ethoxy]benzoyl]oxy-4,5-dihydroxy-benzoic 3-[3,4-dihydroxy-2-[2-(2-methoxy…
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) | 1.72 | 0.77 | -57.58 | 4 | 11 | -1 | 175 | 423.35 | 11 | ↓ |
Hi High (pH 8-9.5) | 1.72 | 1.8 | -119.99 | 3 | 11 | -2 | 178 | 422.342 | 11 | ↓ |