In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 24 | No |
Popular Name: (1E,4Z,6E)-5-hydroxy-7-(4-hydroxy-3-methoxy-phenyl)-1-phenyl-hepta-1,4,6-trien-3-one (1E,4Z,6E)-5-hydroxy-7-(4-hydrox…
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) | 2.96 | 9.98 | -18.81 | 1 | 4 | 0 | 64 | 322.36 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.71 | 8.92 | -54.89 | 1 | 4 | -1 | 70 | 321.352 | 6 | ↓ |