In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2009 | 21 | No |
Popular Name: (E)-3-(4-hydroxy-2-methoxy-3-methyl-phenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one (E)-3-(4-hydroxy-2-methoxy-3-met…
None
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) | 3.50 | 3.78 | -17.25 | 2 | 4 | 0 | 67 | 284.311 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.50 | 4.57 | -50.44 | 1 | 4 | -1 | 70 | 283.303 | 4 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | WO1995006628A1; WO1999000114A2 | IBM Patent Data |