| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2006 | 10 | Yes |
Popular Name: 5-epi-Isofagomine 5-epi-Isofagomine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 202979-51-9 , 957230-65-8
| 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) | -1.94 | -8.57 | -39.03 | 5 | 4 | 1 | 77 | 148.182 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GLCM-2-E | Glucosylceramidase (cluster #2 Of 2), Eukaryotic | Eukaryotes | 110 | 0.97 | Binding ≤ 10μM |
| LPH-1-E | Lactase-glycosylceramidase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 510 | 0.88 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GLCM_HUMAN | P04062 | Beta-glucocerebrosidase, Human | 110 | 0.97 | Binding ≤ 1μM |
| LPH_RAT | Q02401 | Lactase-glycosylceramidase, Rat | 510 | 0.88 | Binding ≤ 1μM |
| GLCM_HUMAN | P04062 | Beta-glucocerebrosidase, Human | 110 | 0.97 | Binding ≤ 10μM |
| LPH_RAT | Q02401 | Lactase-glycosylceramidase, Rat | 510 | 0.88 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Glycosphingolipid metabolism |
