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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 263.3
BDBM50421739

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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
Angiotensin-converting enzyme


(Oryctolagus cuniculus)
BDBM50421739
PNG
(CHEMBL2110192)
Show SMILES C[C@H](SC(C)=O)C(=O)N1CSC[C@H]1C(O)=O
Show InChI InChI=1S/C9H13NO4S2/c1-5(16-6(2)11)8(12)10-4-15-3-7(10)9(13)14/h5,7H,3-4H2,1-2H3,(H,13,14)/t5-,7-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of the activity of rabbit lung Angiotensin I converting enzyme


J Med Chem 29: 784-96 (1986)


BindingDB Entry DOI: 10.7270/Q2F47N4B
More data for this
Ligand-Target Pair