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SMILES: COc1ccc(Nc2nc(N)nc(CN(C)C3CCCCC3)n2)cc1

InChI Key: InChIKey=VCPYKRXTZIABJJ-UHFFFAOYSA-N

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 44539   
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
Protein Rev [8-24]


(Human immunodeficiency virus 1)		BDBM44539
PNG
(6-[(Cyclohexyl-methyl-amino)-methyl]-N-(4-methoxy-...)
Show SMILES COc1ccc(Nc2nc(N)nc(CN(C)C3CCCCC3)n2)cc1
Show InChI InChI=1S/C18H26N6O/c1-24(14-6-4-3-5-7-14)12-16-21-17(19)23-18(22-16)20-13-8-10-15(25-2)11-9-13/h8-11,14H,3-7,12H2,1-2H3,(H3,19,20,21,22,23)
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...

PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2DN43GX
More data for this
Ligand-Target Pair