In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 12 | Yes |
Popular Name: (3S,3aS,5R,6R,6aS)-3,5,6-trihydroxy-3a,5,6,6a-tetrahydro-3H-furo[3,2-b]furan-2-one (3S,3aS,5R,6R,6aS)-3,5,6-trihydr…
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) | -3.49 | -5.88 | -10.85 | 3 | 6 | 0 | 96 | 176.124 | 0 | ↓ |
Hi High (pH 8-9.5) | -3.49 | -5.34 | -48.79 | 2 | 6 | -1 | 99 | 175.116 | 0 | ↓ |