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BDBM50142066 (S)-2-[(1-Cyclohexyl-2-pyridin-2-yl-1H-benzoimidazole-5-carbonyl)-amino]-3-(1H-indol-3-yl)-propionic acid::CHEMBL172902

SMILES: OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1

InChI Key: InChIKey=KSUSHJCKZKOCHT-SANMLTNESA-N

Data: 1 IC50

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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 = 50142066   
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
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)		BDBM50142066
PNG
((S)-2-[(1-Cyclohexyl-2-pyridin-2-yl-1H-benzoimidaz...)
Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
Show InChI InChI=1S/C30H29N5O3/c36-29(34-26(30(37)38)17-20-18-32-23-11-5-4-10-22(20)23)19-13-14-27-25(16-19)33-28(24-12-6-7-15-31-24)35(27)21-8-2-1-3-9-21/h4-7,10-16,18,21,26,32H,1-3,8-9,17H2,(H,34,36)(H,37,38)/t26-/m0/s1
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a



Boehringer Ingelheim (Canada) Ltd

Curated by ChEMBL


Assay Description
Concentration required for inhibiting hepatitis C virus NS5B RNA polymerase activity.

Bioorg Med Chem Lett 14: 967-71 (2004)


Article DOI: 10.1016/j.bmcl.2003.12.032
BindingDB Entry DOI: 10.7270/Q29C6WVF
More data for this
Ligand-Target Pair