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BDBM95761 (2S,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cyclopropyl-2-(4-methylolbenzyl)oxy-3,4-dihydro-2H-pyran-6-carboxamide::(2S,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cyclopropyl-2-[[4-(hydroxymethyl)phenyl]methoxy]-3,4-dihydro-2H-pyran-6-carboxamide::MLS000834621::SMR000442097::cid_16196986

SMILES: OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)NCc2nc3ccccc3[nH]2)C2CC2)cc1

InChI Key: InChIKey=BYWQTSOBKHONAO-DVECYGJZSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 95761   
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
methionyl-tRNA synthetase


(Trypanosoma brucei brucei strain 927/4 GUTat10.1)		BDBM95761
PNG
((2S,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-cycloprop...)
Show SMILES OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)NCc2nc3ccccc3[nH]2)C2CC2)cc1 |c:11|
Show InChI InChI=1S/C25H27N3O4/c29-14-16-5-7-17(8-6-16)15-31-24-12-19(18-9-10-18)11-22(32-24)25(30)26-13-23-27-20-3-1-2-4-21(20)28-23/h1-8,11,18-19,24,29H,9-10,12-15H2,(H,26,30)(H,27,28)/t19-,24+/m1/s1
PDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/a 811n/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