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SMILES: C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cc(CO)ccc2C)CCN1

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 = 50599733   
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))		BDBM50599733
PNG
(CHEMBL5203126)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cc(CO)ccc2C)CCN1 |r,wU:16.16,1.0,wD:19.23,(-3.33,3.47,;-4.67,2.7,;-4.67,1.15,;-6,.38,;-6,-1.16,;-4.67,-1.93,;-3.33,-1.16,;-2,-1.92,;-2,-3.46,;-3.33,-4.23,;-4.67,-3.47,;-6,-4.24,;-.67,-4.23,;-.67,-5.77,;.66,-3.46,;2,-4.23,;.66,-1.92,;-.67,-1.16,;-.67,.38,;.66,1.15,;2,.38,;2,-1.16,;.66,2.69,;2,3.46,;3.34,2.69,;4.67,3.47,;6,2.7,;7.33,3.47,;4.66,5,;3.33,5.77,;2,5,;.66,5.77,;-7.33,1.15,;-7.33,2.7,;-6,3.47,)|
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PC cid
PC sid
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n/an/an/an/a 5.60n/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