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SMILES: Nc1nc(NCC2CCC(CNS(=O)(=O)c3cccc4c(Cl)cccc34)CC2)nc2ccccc12

InChI Key:

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 = 50607942   
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
Aquaporin-1


(Homo sapiens (Human))		BDBM50607942
PNG
(CHEMBL5280011)
Show SMILES Nc1nc(NCC2CCC(CNS(=O)(=O)c3cccc4c(Cl)cccc34)CC2)nc2ccccc12 |(-10.66,-.4,;-9.33,.37,;-7.99,-.39,;-6.66,.38,;-5.33,-.39,;-4,.38,;-2.66,-.39,;-1.33,.38,;0,-.39,;0,-1.93,;1.34,-2.7,;2.67,-1.93,;4.01,-2.7,;3.23,-4.04,;4.78,-4.04,;5.34,-1.93,;5.34,-.39,;6.67,.37,;8,-.4,;8.01,-1.93,;9.34,-2.69,;10.67,-1.92,;9.35,-4.23,;8.03,-5,;6.69,-4.25,;6.68,-2.71,;-1.33,-2.7,;-2.66,-1.93,;-6.67,1.92,;-8,2.68,;-8,4.23,;-9.33,5,;-10.67,4.23,;-10.67,2.68,;-9.33,1.91,)|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 5.80E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair