In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 22nd, 2009 | 18 | No |
Popular Name: (2S)-4,4-dimethoxy-1-[(2R)-2-methyl-3-sulfanyl-propanoyl]pyrrolidine-2-carboxylic (2S)-4,4-dimethoxy-1-[(2R)-2-met…
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) | -1.35 | 3.27 | -56.66 | 0 | 6 | -1 | 79 | 276.334 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4296113; US4311697; US4330548 | IBM Patent Data |