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SMILES: OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)NCc1nc2ccccc2[nH]1)c1ccc(Br)cc1

InChI Key: InChIKey=NISDPNOGGXRBPY-HXOBKFHXSA-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 = 95760   
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
Methionine--tRNA ligase


(Trypanosoma brucei brucei strain 927/4 GUTat10.1)		BDBM95760
PNG
((2S,4S)-N-(1H-benzimidazol-2-ylmethyl)-4-(4-bromop...)
Show SMILES OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)NCc1nc2ccccc2[nH]1)c1ccc(Br)cc1 |c:9|
Show InChI InChI=1S/C24H26BrN3O4/c25-18-9-7-16(8-10-18)17-13-21(32-23(14-17)31-12-4-3-11-29)24(30)26-15-22-27-19-5-1-2-6-20(19)28-22/h1-2,5-10,13,17,23,29H,3-4,11-12,14-15H2,(H,26,30)(H,27,28)/t17-,23+/m1/s1
PDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/a 270n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2XP73JZ
More data for this
Ligand-Target Pair