In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 19 | No |
Popular Name: (1S,4R,5R)-5-(bromomethyl)-6-(p-tolylsulfonyl)-6-azabicyclo[2.2.1]heptane (1S,4R,5R)-5-(bromomethyl)-6-(p-…
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) | 3.31 | 7.13 | -10.16 | 0 | 3 | 0 | 37 | 344.274 | 3 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | WO2000032552A1 | IBM Patent Data |