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SMILES: OC(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(nc2cc(sc12)C(F)F)-c1c[nH]c2ncc(F)cc12

InChI Key: InChIKey=JMWXCXNGCRMLIV-WRQLEZRVSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50507249   
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
Polymerase basic protein 2


(Influenza A virus (strain A/Puerto Rico/8/1934 H1N...)		BDBM50507249
PNG
(CHEMBL4567115)
Show SMILES OC(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(nc2cc(sc12)C(F)F)-c1c[nH]c2ncc(F)cc12 |r,wU:3.2,wD:10.12,(82.44,-44.29,;83.78,-45.06,;85.11,-44.27,;83.79,-46.6,;85.14,-47.37,;85.15,-48.91,;83.81,-49.69,;82.48,-48.93,;83.24,-47.64,;84.36,-48.54,;82.47,-47.38,;81.14,-46.63,;79.83,-47.41,;80.3,-48.86,;79.28,-50,;77.78,-49.7,;77.3,-48.24,;75.89,-47.62,;76.05,-46.08,;77.56,-45.76,;78.33,-47.1,;74.92,-45.06,;75.24,-43.57,;73.46,-45.53,;79.77,-51.45,;78.87,-52.71,;79.78,-53.95,;81.24,-53.47,;82.58,-54.24,;83.92,-53.47,;83.91,-51.91,;85.25,-51.14,;82.58,-51.15,;81.24,-51.93,)|
Show InChI InChI=1S/C23H20F3N5O2S/c24-11-5-12-13(8-28-20(12)27-7-11)21-29-14-6-15(19(25)26)34-18(14)22(31-21)30-17-10-3-1-9(2-4-10)16(17)23(32)33/h5-10,16-17,19H,1-4H2,(H,27,28)(H,32,33)(H,29,30,31)/t9?,10?,16-,17-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 10n/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of PB2 in Influenza A virus (A/Weiss/1943(H1N1)) infected in MDCK cells assessed as reduction in virus induced cell death after 5 days by ...

Eur J Med Chem 162: 249-265 (2019)


Article DOI: 10.1016/j.ejmech.2018.11.015
BindingDB Entry DOI: 10.7270/Q2PG1W2P
More data for this
Ligand-Target Pair