In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 18 | No |
Popular Name: (2S,4S)-1-[(2R)-2-methyl-3-sulfanyl-propanoyl]-4-propoxy-pyrrolidine-2-carboxylic (2S,4S)-1-[(2R)-2-methyl-3-sulfa…
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) | -0.51 | 5.89 | -55.66 | 0 | 5 | -1 | 70 | 274.362 | 6 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US4316906 | IBM Patent Data |