| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 19 | Yes |
Popular Name: 4-oxo-4-(4-pentyloxyphenyl)butyric acid 4-oxo-4-(4-pentyloxyphenyl)butyr…
Find On: PubMed — Wikipedia — Google
CAS Number: 30742-05-3
| 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) | 3.25 | 1.55 | -46.68 | 0 | 4 | -1 | 66 | 263.313 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | WO2000001692A1 | IBM Patent Data |
