BDBM50320768 5-Acetamido-2,6-anhydro-4-{N-[3-(morpholinocarbonyl)propyl]guanidino}-3,4,5-trideoxy-D-glycero-D-galactonon-2-enonic acid::CHEMBL1164661

SMILES: CC(=O)N[C@H]1[C@@H](OC(=C[C@@H]1N(CCCC(=O)N1CCOCC1)C(N)=N)C(O)=O)[C@H](O)[C@H](O)CO

InChI Key: InChIKey=DTCQXQDEGOQCSO-NYMASUJMSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50320768   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neuraminidase (Influenza A virus)	BDBM50320768 (5-Acetamido-2,6-anhydro-4-{N-[3-(morpholinocarbony...) Show SMILES CC(=O)N[C@H]1[C@@H](OC(=C[C@@H]1N(CCCC(=O)N1CCOCC1)C(N)=N)C(O)=O)[C@H](O)[C@H](O)CO |r,c:7| Show InChI InChI=1S/C20H33N5O9/c1-11(27)23-16-12(9-14(19(31)32)34-18(16)17(30)13(28)10-26)25(20(21)22)4-2-3-15(29)24-5-7-33-8-6-24/h9,12-13,16-18,26,28,30H,2-8,10H2,1H3,(H3,21,22)(H,23,27)(H,31,32)/t12-,13+,16+,17+,18+/m0/s1	PDB MMDB B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Taiwan University Curated by ChEMBL					Assay Description Inhibition of Influenza A virus A/WSN/1933(H1N1) neuraminidase				Bioorg Med Chem 18: 4074-84 (2010) Article DOI: 10.1016/j.bmc.2010.04.010 BindingDB Entry DOI: 10.7270/Q2WD41KC
					More data for this Ligand-Target Pair