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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50021151   
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


(Homo sapiens (Human))
BDBM50021151
PNG
(6-tert-Butoxycarbonylamino-2-(1-carboxymethyl-2-ox...)
Show SMILES CC(C)(C)OC(=O)NCCCC[C@H](N[C@H]1CCc2ccccc2N(CC(O)=O)C1=O)C(O)=O
Show InChI InChI=1S/C23H33N3O7/c1-23(2,3)33-22(32)24-13-7-6-9-17(21(30)31)25-16-12-11-15-8-4-5-10-18(15)26(20(16)29)14-19(27)28/h4-5,8,10,16-17,25H,6-7,9,11-14H2,1-3H3,(H,24,32)(H,27,28)(H,30,31)/t16-,17-/m0/s1
PDB
MMDB

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PubMed
n/an/a 4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Angiotensin I converting enzyme


J Med Chem 28: 1603-6 (1985)


BindingDB Entry DOI: 10.7270/Q2ZK5H7D
More data for this
Ligand-Target Pair