In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 9 | Yes |
Popular Name: (3aS,6aR)-1,3a,4,5,6,6a-hexahydrocyclopenta[c]furan-3-one (3aS,6aR)-1,3a,4,5,6,6a-hexahydr…
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) | 0.54 | 4.48 | -7.71 | 0 | 2 | 0 | 26 | 126.155 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | WO1999032649A1 | IBM Patent Data |