In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2009 | 28 | Yes |
Popular Name: 1-[4-[4-(2,3-dimethoxyphenyl)butoxy]-2-hydroxy-3-propyl-phenyl]ethanone 1-[4-[4-(2,3-dimethoxyphenyl)but…
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 |
---|---|---|---|---|---|---|---|---|---|---|
Hi High (pH 8-9.5) | 5.25 | 11.69 | -57.89 | 0 | 5 | -1 | 68 | 385.48 | 11 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5025036; US5191108 | IBM Patent Data |