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SMILES: CC(C)(C)OC(=O)N1CCC(CC1)Oc1cc(ccc1NC(=O)c1cc(Br)c(Br)[nH]1)C(=O)NCC(O)=O

InChI Key: InChIKey=BINBUXZIKUNKAE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50249811   
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
DNA gyrase subunit A/B


(Escherichia coli (strain K12))		BDBM50249811
PNG
(CHEMBL4778649)
Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)Oc1cc(ccc1NC(=O)c1cc(Br)c(Br)[nH]1)C(=O)NCC(O)=O
Show InChI InChI=1S/C19H16FN3O4S/c1-11-6-13-8-14(9-15(20)18(13)23(2)19(11)24)22-28(25,26)17-5-4-12(10-21)7-16(17)27-3/h4-9,22H,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
n/an/a 630n/an/an/an/an/an/a


TBA

Assay Description
Evaluated for the percent binding affinity against H1 receptor by an H1 histamine-mediated bronchospasm

Citation and Details
More data for this
Ligand-Target Pair