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SMILES: [Na;v0+].[H][C@]1([#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#8]-[#6]-2-[#6]C3([#6]-2)[#6]-[#7](-[#6]3)-[#6](=O)-[#6]-c2ccccc2)-[#6](=O)-[#6](-[#8])S([#8-])(=O)=O)[#6]-[#6]-[#7]-[#6]1=O

InChI Key:

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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50606187   
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
Replicase polyprotein 1ab


(2019-nCoV)		BDBM50606187
PNG
(CHEMBL5209543)
Show SMILES [Na;v0+].[H][C@]1([#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#8]-[#6]-2-[#6]C3([#6]-2)[#6]-[#7](-[#6]3)-[#6](=O)-[#6]-c2ccccc2)-[#6](=O)-[#6](-[#8])S([#8-])(=O)=O)[#6]-[#6]-[#7]-[#6]1=O |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 260n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00224
BindingDB Entry DOI: 10.7270/Q2MC944V
More data for this
Ligand-Target Pair