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SMILES: CN(C(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(F)cc1)c1ccc(CN2CCNCC2)c(C)c1

InChI Key:

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50599727   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Motilin receptor


(Homo sapiens (Human))		BDBM50599727
PNG
(CHEMBL5179463)
Show SMILES CN(C(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(F)cc1)c1ccc(CN2CCNCC2)c(C)c1 |r,wU:4.3,wD:7.10,(-0,-5.77,;-0,-4.23,;1.33,-3.46,;2.67,-4.23,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.67,.39,;2.67,-1.15,;1.33,2.7,;2.67,3.47,;2.67,5.01,;4,5.77,;5.33,5,;6.66,5.77,;5.33,3.47,;4.01,2.69,;-1.33,-3.46,;-1.33,-1.92,;-2.66,-1.15,;-4,-1.92,;-5.33,-1.15,;-5.33,.39,;-6.66,1.16,;-6.66,2.7,;-5.33,3.47,;-4,2.7,;-4,1.16,;-4,-3.47,;-5.33,-4.24,;-2.66,-4.23,)|
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n/an/an/an/a 46n/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair