| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 17 | Yes |
Popular Name: 1-[3-methoxy-4-(3-methylbutoxy)phenyl]ethan-1-one 1-[3-methoxy-4-(3-methylbutoxy)p…
Find On: PubMed — Wikipedia — Google
CAS Number: 1016880-51-5
| 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) | 3.14 | 7.24 | -10.05 | 0 | 3 | 0 | 36 | 236.311 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0125636A1; US4707481 | IBM Patent Data |
