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BDBM50065900 (S)-2-Benzyl-4-oxo-azetidine-1-carboxylic acid methyl-(4-trifluoromethanesulfinyl-benzyl)-amide::CHEMBL95515

SMILES: CN(Cc1ccc(cc1)S(=O)C(F)(F)F)C(=O)N1[C@@H](Cc2ccccc2)CC1=O

InChI Key: InChIKey=CVMXFRQGRMMRMB-NUZMYHNKSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50065900   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Human rhinovirus A protease


(Human rhinovirus B)
BDBM50065900
PNG
((S)-2-Benzyl-4-oxo-azetidine-1-carboxylic acid met...)
Show SMILES CN(Cc1ccc(cc1)S(=O)C(F)(F)F)C(=O)N1[C@@H](Cc2ccccc2)CC1=O
Show InChI InChI=1S/C20H19F3N2O3S/c1-24(13-15-7-9-17(10-8-15)29(28)20(21,22)23)19(27)25-16(12-18(25)26)11-14-5-3-2-4-6-14/h2-10,16H,11-13H2,1H3/t16-,29?/m0/s1
MMDB

UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.70E+3n/an/an/an/an/an/a



Boehringer Ingelheim (Canada) Ltd

Curated by ChEMBL


Assay Description
Inhibitory activity against human cytomegalovirus (HCMV) protease


J Med Chem 41: 2882-91 (1998)


Article DOI: 10.1021/jm980131z
BindingDB Entry DOI: 10.7270/Q2X63M2J
More data for this
Ligand-Target Pair