In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 12 | No |
Popular Name: (2S,3R,4R,5S,6S)-2-(hydroxymethyl)-6-sulfanyl-tetrahydropyran-3,4,5-triol (2S,3R,4R,5S,6S)-2-(hydroxymethy…
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) | -1.69 | -8.99 | -12.31 | 4 | 5 | 0 | 90 | 196.224 | 1 | ↓ |
Hi High (pH 8-9.5) | -1.69 | -8.51 | -52.66 | 4 | 5 | -1 | 90 | 195.216 | 1 | ↓ |