Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(3S,6S,9S,12S,75S,78S,81S,84S,87S,91S,94S,97S,100S,103S,106S,109S,112S,118S,121S,125S,129S,132S,135S,138S,141S,144S,147S,150S,153S,156S,162S)-94-((1H-indol-3-yl)methyl)-162-((S)-2-acetamido-4-methylpentanamido)-75,103,132-tris(5-acetamidopentyl)-12,78,81,106,135,147-hexakis(4-aminobutyl)-129-sec-butyl-109-butyl-6,9,118,150,156-pentakis(2-carboxyethyl)-84,141,153-tris(3-guanidinopropyl)-97-((R)-1-hydroxyethyl)-91,100-bis(hydroxymethyl)-144-isopropyl-87,121,125,138-tetramethyl-112-(2-(methylthio)ethyl)-3-nonadecanoyl-5,8,11,14,18,34,38,54,58,74,77,80,83,86,90,93,96,99,102,105,108,111,114,117,120,124,128,131,134,137,140,143,146,149,152,155,158,161-octatriacontaoxo-16,23,26,29,36,43,46,49,56,63,66,69-dodecaoxa-4,7,10,13,19,33,39,53,59,73,76,79,82,85,89,92,95,98,101,104,107,110,113,116,119,123,127,130,133,136,139,142,145,148,151,154,157,160-octatriacontaazatetrahexacontahectane-1,164-dicarboxylic acid
    Show/Hide
 PubChem ID
CID: 162667576
Canonical SMILES
CCCCCCCCCCCCCCCCCCC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)COCC(=O)NCCCOCCOCCOCCCNC(=O)COCC(=O)NCCCOCCOCCOCCCNC(=O)COCC(=O)NCCCOCCOCCOCCCNC(=O)[C@H](CCCCCNC(C)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCCNC(C)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCC)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)CNC(=O)[C@@H](C)CNC(=O)[C@@H](NC(=O)[C@H](CCCCCNC(C)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(C)=O)C(C)C)[C@@H](C)CC)[C@@H](C)O
    Show/Hide
Compound Formula C246H433N59O73S
Compound Structure
Protein Name
 Protein Info 
Relaxin receptor 1
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
>
Relaxin-like peptide receptor (family A GPCR)
>
Relaxin receptor
Uniprot ID
Q9HBX9
Gene Name
RXFP1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000708 OVCAR-5
 Cell Line Info 
Homo sapiens (Human)  2
1
EC50 = 0.4 nM
   TI
   LI
   LO
   TS
2
EC50 = 24.5 nM
   TI
   LI
   LO
   TS