Brief Information of the Compound and Protein
Compound Name
 Compound Info 
benzyl N-(2-amino-2-oxoethyl)-N-[2-[[(2S,4S)-1-[(3-chlorophenyl)-phenylcarbamoyl]-4-(dipentylcarbamoyl)piperidine-2-carbonyl]amino]ethyl]carbamate
    Show/Hide
 PubChem ID
CID: 44370354
Canonical SMILES
CCCCCN(CCCCC)C(=O)[C@H]1CCN([C@@H](C1)C(=O)NCCN(CC(N)=O)C(=O)OCc1ccccc1)C(=O)N(c1ccccc1)c1cccc(Cl)c1
    Show/Hide
Compound Formula C42H55ClN6O6
Compound Structure
Protein Name
 Protein Info 
Substance-P receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
>
Short peptide receptor (family A GPCR)
>
Neurokinin receptor
Uniprot ID
P25103
Gene Name
TACR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
IC50 = 1.8 nM
   TI
   LI
   LO
   TS