| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2005 | 9 | Yes |
Popular Name: 1,4-Dideoxy-1,4-imino-D-ribitol 1,4-Dideoxy-1,4-imino-D-ribitol
Find On: PubMed — Wikipedia — Google
CAS Number: 100937-52-8
| 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) | -1.98 | -6.41 | -36.71 | 5 | 4 | 1 | 77 | 134.155 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.98 | -7.71 | -5.92 | 4 | 4 | 0 | 73 | 133.147 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5801247 | IBM Patent Data |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| B1WC34-1-E | Alpha-glucosidase II Beta Subunit (cluster #1 Of 1), Eukaryotic | Eukaryotes | 9700 | 0.78 | Binding ≤ 10μM |
| D3ZAN3-1-E | Alpha-glucosidase II (cluster #1 Of 1), Eukaryotic | Eukaryotes | 9700 | 0.78 | Binding ≤ 10μM |
| GANC-1-E | Neutral Alpha-glucosidase C (cluster #1 Of 2), Eukaryotic | Eukaryotes | 5800 | 0.81 | Binding ≤ 10μM |
| O70282-1-E | Trehalase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 4800 | 0.83 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| D3ZAN3_RAT | D3ZAN3 | Alpha-glucosidase II, Rat | 9700 | 0.78 | Binding ≤ 10μM |
| B1WC34_RAT | B1WC34 | Alpha-glucosidase II Beta Subunit, Rat | 9700 | 0.78 | Binding ≤ 10μM |
| GANC_MOUSE | Q8BVW0 | Neutral Alpha-glucosidase C, Mouse | 5800 | 0.81 | Binding ≤ 10μM |
| O70282_RAT | O70282 | Trehalase, Rat | 4800 | 0.83 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Advanced glycosylation endproduct receptor signaling | |
| Calnexin/calreticulin cycle | |
| N-glycan trimming in the ER and Calnexin/Calreticulin cycle |
