| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 16 | 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) | 3.16 | 8.02 | -12.19 | 0 | 2 | 0 | 22 | 227.288 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MPI-1-E | Mannose-6-phosphate Isomerase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 6400 | 0.45 | Binding ≤ 10μM |
| Z50591-1-O | Bos Taurus (cluster #1 Of 2), Other | Other | 3000 | 0.48 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MPI_HUMAN | P34949 | Mannose-6-phosphate Isomerase, Human | 6400 | 0.45 | Binding ≤ 10μM |
| Z50591 | Z50591 | Bos Taurus | 3000 | 0.48 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Synthesis of GDP-mannose |
