| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2008 | 12 | Yes |
Popular Name: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-methyl-piperidine-3,4,5-triol (2R,3R,4S,5R,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) | -2.07 | -8.43 | -32.26 | 6 | 5 | 1 | 98 | 178.208 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FUCO-3-E | Alpha-L-fucosidase 1 (cluster #3 Of 3), Eukaryotic | Eukaryotes | 6 | 0.96 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FUCO_HUMAN | P04066 | Alpha-L-fucosidase I, Human | 5.8 | 0.96 | Binding ≤ 1μM |
| FUCO_HUMAN | P04066 | Alpha-L-fucosidase I, Human | 5.8 | 0.96 | Binding ≤ 10μM |
