Brief Information of the Compound and Protein
Compound Name
 Compound Info 
N-[(3R,6S)-6-(2,3-difluorophenyl)-2-oxo-1-(2,2,2-trifluoroethyl)azepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
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 PubChem ID
CID: 11319053
SID: 50086919
Canonical SMILES
Fc1cccc([C@@H]2CC[C@@H](NC(=O)N3CCC(CC3)n3c4cccnc4[nH]c3=O)C(=O)N(CC(F)(F)F)C2)c1F
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Compound Formula C26H27F5N6O3
Compound Structure
Protein Name
 Protein Info 
Calcitonin gene-related peptide type 1 receptor
Protein Classification
Membrane receptor
>
Family B G protein-coupled receptor
>
Peptide receptor (family B GPCR)
>
Calcitonin-like receptor
>
Calcitonin gene-related peptide receptor
Uniprot ID
Q16602
Gene Name
CALCRL
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  5
1
IC50 = 2 nM
   TI
   LI
   LO
   TS
2
IC50 = 2.4 nM
   TI
   LI
   LO
   TS
3
IC50 = 11 nM
   TI
   LI
   LO
   TS
4
Ki = 0.77 nM
   TI
   LI
   LO
   TS
5
Ki = 0.8 nM
   TI
   LI
   LO
   TS
CL000748 NAL1A clone C4E10
 Cell Line Info 
Mus musculus (Mouse)  2
1
IC50 = 2.2 nM
   TI
   LI
   LO
   TS
2
IC50 = 11 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Kd = 1.9 nM
2 Kd = 3.715 nM
3 Ki = 0.77 nM
4 Ki = 0.8 nM