In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2005 | 12 | No |
Popular Name: Sodium (2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-thiolate Sodium (2S,3R,4S,5R,6R)-3,4,5-tr…
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CAS Numbers: 42891-22-5 , [42891-22-5]
"¦Â-D-Thiogalactose sodium salt, 98%"
1-THIO-BETA-D-GALACTOPYRANOSE SODIUM SALT
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 | -10.71 | -6.63 | 4 | 5 | 0 | 90 | 196.224 | 1 | ↓ |
Hi High (pH 8-9.5) | -1.69 | -11.67 | -48.27 | 4 | 5 | -1 | 90 | 195.216 | 1 | ↓ |