| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2006 | 20 | No |
Popular Name: 4-amino-2-deoxy-2,3-didehydro-N-acetylneuraminicacid 4-amino-2-deoxy-2,3-didehydro-N-…
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CAS Number: 130525-62-1
| 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) | -3.50 | -11.28 | -76.12 | 7 | 9 | 0 | 166 | 290.272 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| A8K327-1-E | Sialidase 3 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 40 | 0.52 | Binding ≤ 10μM |
| A8K327-1-E | Sialidase 3 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 40 | 0.52 | Binding ≤ 10μM |
| NEUR1-1-E | Sialidase 1 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 40 | 0.52 | Binding ≤ 10μM |
| NEUR1-1-E | Sialidase 1 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 40 | 0.52 | Binding ≤ 10μM |
| NEUR2-1-E | Sialidase 2 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 40 | 0.52 | Binding ≤ 10μM |
| NEUR2-1-E | Sialidase 2 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 40 | 0.52 | Binding ≤ 10μM |
| NEUR4-1-E | Sialidase 4 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 40 | 0.52 | Binding ≤ 10μM |
| NEUR4-1-E | Sialidase 4 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 40 | 0.52 | Binding ≤ 10μM |
| NRAM-1-V | Neuraminidase (cluster #1 Of 2), Viral | Viruses | 410 | 0.45 | Binding ≤ 10μM |
| Z50652-1-O | Influenza A Virus (cluster #1 Of 4), Other | Other | 1500 | 0.41 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| NRAM_INBLE | P03474 | Neuraminidase, Inble | 400 | 0.45 | Binding ≤ 1μM |
| NRAM_I34A1 | P03468 | Neuraminidase, I34a1 | 300 | 0.46 | Binding ≤ 1μM |
| NEUR1_HUMAN | Q99519 | Sialidase 1, Human | 300 | 0.46 | Binding ≤ 1μM |
| NEUR2_HUMAN | Q9Y3R4 | Sialidase 2, Human | 300 | 0.46 | Binding ≤ 1μM |
| A8K327_HUMAN | A8K327 | Sialidase 3, Human | 300 | 0.46 | Binding ≤ 1μM |
| NEUR4_HUMAN | Q8WWR8 | Sialidase 4, Human | 300 | 0.46 | Binding ≤ 1μM |
| NRAM_INBLE | P03474 | Neuraminidase, Inble | 400 | 0.45 | Binding ≤ 10μM |
| NRAM_I34A1 | P03468 | Neuraminidase, I34a1 | 300 | 0.46 | Binding ≤ 10μM |
| NEUR1_HUMAN | Q99519 | Sialidase 1, Human | 300 | 0.46 | Binding ≤ 10μM |
| NEUR2_HUMAN | Q9Y3R4 | Sialidase 2, Human | 300 | 0.46 | Binding ≤ 10μM |
| A8K327_HUMAN | A8K327 | Sialidase 3, Human | 300 | 0.46 | Binding ≤ 10μM |
| NEUR4_HUMAN | Q8WWR8 | Sialidase 4, Human | 300 | 0.46 | Binding ≤ 10μM |
| Z50652 | Z50652 | Influenza A Virus | 1500 | 0.41 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Assembly of Viral Components at the Budding Site | |
| Budding | |
| Entry of Influenza Virion into Host Cell via Endocytosis | |
| Fusion of the Influenza Virion to the Host Cell Endosome | |
| Glycosphingolipid metabolism | |
| Influenza Life Cycle | |
| Influenza Virus Induced Apoptosis | |
| Packaging of Eight RNA Segments | |
| Release | |
| Sialic acid metabolism | |
| Transport of HA trimer, NA tetramer and M2 tetramer from the endoplasmic reticul | |
| Uncoating of the Influenza Virion | |
| Viral mRNA Translation |
