Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(3S,6R,13R,16S,19S,22S,25S,28S,33aS)-19-((1H-imidazol-5-yl)methyl)-28-((1H-indol-3-yl)methyl)-13-acetamido-22-benzyl-3-((S)-sec-butyl)-25-(3-guanidinopropyl)-16-((R)-1-hydroxyethyl)-24-methyl-1,4,14,17,20,23,26,29-octaoxotriacontahydro-11H-pyrrolo[2,1-k][1,2]dithia[6,9,12,15,18,21,24,27]octaazacyclohentriacontine-6-carboxamide
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 PubChem ID
CID: 168277258
Canonical SMILES
CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(=N)N)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](NC(C)=O)CCSSCC[C@H](C(N)=O)NC1=O
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Compound Formula C58H82N16O11S2
Compound Structure
Protein Name
 Protein Info 
Melanocyte-stimulating hormone receptor
Protein Classification
Membrane receptor
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Family A G protein-coupled receptor
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Peptide receptor (family A GPCR)
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Short peptide receptor (family A GPCR)
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Melanocortin receptor
Uniprot ID
Q01726
Gene Name
MC1R
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000154 HEK293-EBNA1-6E
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 4.786 nM
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   LO
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