| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 8 | Yes |
| 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) | -1.00 | -4.45 | -40.36 | 4 | 3 | 1 | 57 | 118.156 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.00 | -5.75 | -6.37 | 3 | 3 | 0 | 52 | 117.148 | 0 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FUCO-3-E | Alpha-L-fucosidase 1 (cluster #3 Of 3), Eukaryotic | Eukaryotes | 2000 | 1.00 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FUCO_HUMAN | P04066 | Alpha-L-fucosidase I, Human | 2000 | 1.00 | Binding ≤ 10μM |
