In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 12 | Yes |
Popular Name: (3S,4R,5R)-3-hydroxy-5-[(1S)-1-hydroxyethyl]-4-methoxy-tetrahydrofuran-2-one (3S,4R,5R)-3-hydroxy-5-[(1S)-1-h…
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) | -2.32 | -0.94 | -12.64 | 2 | 5 | 0 | 76 | 176.168 | 2 | ↓ |
Hi High (pH 8-9.5) | -2.32 | -0.18 | -54.41 | 1 | 5 | -1 | 79 | 175.16 | 2 | ↓ |