Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(2S)-1-[(2R,3S)-5-chloro-3-(2-chlorophenyl)-1-(3,4-dimethoxybenzenesulfonyl)-3-hydroxy-2,3-dihydro-1H-indole-2-carbonyl]-pyrrolidine-2-carboxamide
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 PubChem ID
CID: 60943
SID: 14863085
Canonical SMILES
COc1ccc(cc1OC)S(=O)(=O)N1[C@@H](C(=O)N2CCC[C@H]2C(N)=O)[C@](O)(c2cc(Cl)ccc12)c1ccccc1Cl
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Compound Formula C28H27Cl2N3O7S
Compound Structure
Protein Name
 Protein Info 
Vasopressin V1a receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
>
Short peptide receptor (family A GPCR)
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Vasopressin and oxytocin receptor
Uniprot ID
P37288
Gene Name
AVPR1A
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)  5
1
IC50 = 13 nM
   TI
   LI
   LO
   TS
2
Ki = 0.53 nM
   TI
   LI
   LO
   TS
3
Ki = 0.7 nM
   TI
   LI
   LO
   TS
4
Ki = 0.9 nM
   TI
   LI
   LO
   TS
5
Ki = 1.48 nM
   TI
   LI
   LO
   TS
CL000053 COS-7
 Cell Line Info 
Chlorocebus aethiops (Green monkey)  3
1
Ki = 0.19 nM
   TI
   LI
   LO
   TS
2
Ki = 0.52 nM
   TI
   LI
   LO
   TS
3
Ki = 0.85 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 2 nM