In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 29 | No |
Popular Name: (4R)-3-[(3S,4S)-1-benzyl-4-cyclopropyl-pyrrolidine-3-carbonyl]-4-phenyl-oxazolidin-2-one (4R)-3-[(3S,4S)-1-benzyl-4-cyclo…
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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) | 3.86 | 13.08 | -39.09 | 1 | 5 | 1 | 51 | 391.491 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.86 | 10.63 | -8.96 | 0 | 5 | 0 | 50 | 390.483 | 5 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US5618949; US5668164 | IBM Patent Data |