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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50003169'   
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
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50003169
PNG
(CHEMBL4066436)
Show SMILES Clc1cccc(c1)C(=O)NCC1NCCc2ccccc12
Show InChI InChI=1S/C37H55N5O9/c43-32-15-7-13-27(23-42-17-19-49-20-18-42)51-37(48)33(44)29(21-25-9-3-1-4-10-25)39-36(47)31(24-50-32)41-35(46)30(22-26-11-5-2-6-12-26)40-34(45)28-14-8-16-38-28/h2,5-6,11-12,25,27-31,33,38,44H,1,3-4,7-10,13-24H2,(H,39,47)(H,40,45)(H,41,46)/t27-,28?,29+,30?,31+,33-/m1/s1
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PC cid
PC sid
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n/an/a 170n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL




Eur J Med Chem 126: 202-217 (2017)


BindingDB Entry DOI: 10.7270/Q2RB76TS
More data for this
Ligand-Target Pair