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SMILES: Cl.NC(=N)N1CC23CC45CC2(C1)CC4(C3)CCCC5

InChI Key: InChIKey=KMLDGRLMXQUCFB-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50494442   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Matrix protein 2 [1-96]


(Influenza A virus)		BDBM50494442
PNG
(CHEMBL3088292)
Show SMILES Cl.NC(=N)N1CC23CC45CC2(C1)CC4(C3)CCCC5 |TLB:15:13:7:10.9,11:10:7:13.14,THB:12:13:7:10.9,12:10:7:13.14,(50.7,-47.54,;53.17,-52.02,;51.8,-51.23,;51.8,-49.65,;50.4,-52.03,;49.04,-52.9,;47.7,-52.6,;47.41,-51.36,;45.66,-51.59,;48.14,-52.14,;48.19,-53.62,;49.64,-53.97,;47.19,-54.69,;45.6,-53.35,;46.88,-53.99,;44.15,-53.86,;42.87,-53.12,;42.95,-51.41,;44.34,-50.75,)|
Show InChI InChI=1S/C15H23N3/c16-11(17)18-9-14-5-12-3-1-2-4-13(12,7-14)8-15(14,6-12)10-18/h1-10H2,(H3,16,17)
UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 290n/an/an/an/an/an/a



Universitat de Barcelona

Curated by ChEMBL


Assay Description
Inhibition of Influenza A virus Udorn/72 M2 ion channel V27A mutant expressed in Xenopus oocyte plasma membranes after 2 mins by two-electrode voltag...

J Med Chem 56: 9265-74 (2013)


Article DOI: 10.1021/jm401340p
BindingDB Entry DOI: 10.7270/Q2HH6P00
More data for this
Ligand-Target Pair