In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2011 | 23 | Yes |
Popular Name: (2R,7S,9aS)-2-tert-butyl-7-(2,4-dichlorophenyl)-1,3,4,6,7,8,9,9a-octahydroquinolizin-2-ol (2R,7S,9aS)-2-tert-butyl-7-(2,4-…
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) | 5.14 | 9.87 | -41.56 | 2 | 2 | 1 | 25 | 357.345 | 2 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US4236010 | IBM Patent Data |