In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 9th, 2010 | 23 | Yes |
Popular Name: 7-(4-hexyloxyphenyl)-7-oxoheptanoic acid 7-(4-hexyloxyphenyl)-7-oxoheptan…
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CAS Number: 898792-12-6
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) | 5.27 | 12.19 | -51.15 | 0 | 4 | -1 | 66 | 319.421 | 13 | ↓ |
Lo Low (pH 4.5-6) | 5.27 | 10.21 | -13.12 | 1 | 4 | 0 | 64 | 320.429 | 13 | ↓ |