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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Chymotrypsin' and Ligand = 'BDBM50405196'   
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
Chymotrypsin


(Homo sapiens (Human))
BDBM50405196
PNG
(CHEMBL54748)
Show SMILES CCCCC(C(=O)c1ccccc1)c1oc(=O)c(CCCC)c(O)c1CCCC
Show InChI InChI=1S/C25H34O4/c1-4-7-15-19(22(26)18-13-11-10-12-14-18)24-20(16-8-5-2)23(27)21(17-9-6-3)25(28)29-24/h10-14,19,27H,4-9,15-17H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
7.94E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine Chymotrypsinogen expressed as inhibitory constant


J Med Chem 28: 1828-32 (1986)


BindingDB Entry DOI: 10.7270/Q28S4R4F
More data for this
Ligand-Target Pair