| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 13 | Yes |
Popular Name: 4-Oxo-4-(4-pyridyl)butyric acid 4-Oxo-4-(4-pyridyl)butyric acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 5693-75-4 , [5693-75-4]
| 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) | -0.04 | 3.81 | -45.95 | 0 | 4 | -1 | 70 | 178.167 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 139 - 141 | Enamine Building Blocks |
| MP | 139...141 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| Purity | 94% | Fluorochem |
| purity | 95 | Enamine Building Blocks |
| PUBCHEM_PATENT_ID | US4298609; US4304775; US4304776; US4304777; US4305943; US4337253; US4338446; US4346221; US4354026; US4486431; US4590194 | IBM Patent Data |
