In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 13th, 2009 | 21 | No |
Popular Name: (2S)-1-[(2R)-3-acetylsulfanyl-2-methyl-propanoyl]-4,4-dimethoxy-pyrrolidine-2-carboxylic (2S)-1-[(2R)-3-acetylsulfanyl-2-…
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) | -0.89 | 5.59 | -62.91 | 0 | 7 | -1 | 96 | 318.371 | 7 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US4296113; US4311697; US4330548 | IBM Patent Data |