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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Chymotrypsinogen B' and Ligand = 'BDBM50025862'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Chymotrypsinogen B


(Homo sapiens (Human))		BDBM50025862
PNG
(CHEMBL58706 | N-[1R-(2-phenyl ethyl)]acetamide bor...)
Show SMILES CC(=O)N[C@@H](Cc1ccccc1)B(O)O
Show InChI InChI=1S/C10H14BNO3/c1-8(13)12-10(11(14)15)7-9-5-3-2-4-6-9/h2-6,10,14-15H,7H2,1H3,(H,12,13)/t10-/m0/s1
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PC cid
PC sid
UniChem

Similars
PubMed
 2.10E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competetive inhibition of alpha-chymotrypsin

J Med Chem 28: 1917-25 (1986)


BindingDB Entry DOI: 10.7270/Q22B8X1B
More data for this
Ligand-Target Pair