In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 23 | No |
Popular Name: (2S,5S)-5-(3,4-dimethoxyphenyl)-1-(3-sulfanylpropanoyl)pyrrolidine-2-carboxylic (2S,5S)-5-(3,4-dimethoxyphenyl)-…
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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) | -0.34 | 8.48 | -58.64 | 0 | 6 | -1 | 79 | 338.405 | 6 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US4290952; US4320057 | IBM Patent Data |