In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2010 | 35 | No |
Popular Name: [(E,1S)-1-[[(2S,3S)-3-hexyl-4-oxo-oxetan-2-yl]methyl]dodec-4-enyl] [(E,1S)-1-[[(2S,3S)-3-hexyl-4-ox…
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) | 8.82 | 18.65 | -13.9 | 1 | 6 | 0 | 82 | 493.729 | 22 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US4931463; US4983746; US5175186; US5246960 | IBM Patent Data |