In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 29th, 2009 | 21 | No |
Popular Name: 2-[(E)-6,6-dimethylhept-2-en-4-ynoxy]isoindoline-1,3-dione 2-[(E)-6,6-dimethylhept-2-en-4-y…
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) | 4.30 | 9.98 | -12.45 | 0 | 4 | 0 | 48 | 283.327 | 3 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | EP0341048A1; US5021446 | IBM Patent Data |