Ligand
Ligand Name:   FeqGuDFSA
Ligand Type:   D-saccharide
Ligand ID:   COVPDB1504 PubChem:   102432074
Synonym(s):  
  •   2,3beta-difluoro-4-guanidino-n-acetyl-2,4-dideoxy-alpha-neuraminic acid
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC(=O)N[C@@H]1[C@@H](NC(N)=N)[C@H](F)[C@@](F)(O[C@H]1[C@H](O)[C@H](O)CO)C(O)=O
Standard InChI:   InChI=1S/C12H20F2N4O7/c1-3(20)17-5-6(18-11(15)16)9(13)12(14,10(23)24)25-8(5)7(22)4(21)2-19/h4-9,19,21-22H,2H2,1H3,(H,17,20)(H,23,24)(H4,15,16,18)/t4-,5-,6-,7-,8-,9+,12-/m1/s1
Molecular Formula:   C12H20F2N4O7 Mol. Weight:   370.13 logP:   -3.45583
HBD:   8 HBA:   7
#Rotatable Bonds:   6 TPSA:   198.22

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Neuraminidase P03472 (NRAM_I75A5) Influenza A virus (strain A/Tern/Australia/G70C/1975 H11N9) 3W09 ZGE
-
-
SHOW