BDBM50128045 ALLYL-{6-[3-(4-BROMO-PHENYL)-BENZOFURAN-6-YLOXY]-HEXYL-}-METHYL-AMIN::Allyl-{6-[3-(4-bromo-phenyl)-benzofuran-6-yloxy]-hexyl}-methyl-amine::CHEMBL445353::N-allyl-6-(3-(4-bromophenyl)benzofuran-6-yloxy)-N-methylhexan-1-aminium

SMILES: C[N@@](CCCCCCOc1ccc2c(c1)occ2c3ccc(cc3)Br)CC=C

InChI Key: InChIKey=JYNZIOFUHBJABQ-UHFFFAOYSA-N

Data: 4 IC50

PDB links: 1 PDB ID matches this monomer.

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 4 hits for monomerid = 50128045   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Lanosterol synthase (Human)	BDBM50128045 (Allyl-{6-[3-(4-bromo-phenyl)-benzofuran-6-yloxy]-h...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Squalene--hopene cyclase (Alicyclobacillus acidocaldarius)	BDBM50128045 (Allyl-{6-[3-(4-bromo-phenyl)-benzofuran-6-yloxy]-h...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lanosterol synthase (Human)	BDBM50128045 (Allyl-{6-[3-(4-bromo-phenyl)-benzofuran-6-yloxy]-h...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	617	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Lanosterol synthase (Human)	BDBM50128045 (Allyl-{6-[3-(4-bromo-phenyl)-benzofuran-6-yloxy]-h...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	617	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair