Brief Information of the Compound and Protein
Compound Name
N-[(3R,6S)-6-(2,3-difluorophenyl)-2-oxo-1-(2,2,2-trifluoroethyl)azepan-3-yl]-1-oxo-3-phenyl-2,8-diazaspiro[4.5]decane-8-carboxamide
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PubChem ID
CID: 11599531
SID: 16702118
Canonical SMILES
Fc1cccc([C@@H]2CC[C@@H](NC(=O)N3CCC4(CC(NC4=O)c4ccccc4)CC3)C(=O)N(CC(F)(F)F)C2)c1F
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Compound Formula C29H31F5N4O3
Compound Structure
Protein Name
Calcitonin gene-related peptide type 1 receptor
Protein Classification
Membrane receptor
>
Family B G protein-coupled receptor
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Peptide receptor (family B GPCR)
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Calcitonin-like receptor
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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 Homo sapiens (Human)  3
1
IC50 = 120 nM
   TI
   LI
   LO
   TS
2
IC50 = 692 nM
   TI
   LI
   LO
   TS
3
Ki = 380 nM
   TI
   LI
   LO
   TS