Brief Information of the Compound and Protein
Compound Name
methyl 2-[7-chloro-1-(4-pyridin-2-yloxycyclohexyl)-4,5-dihydro-[1,2,4]triazolo[4,3-a]quinolin-4-yl]acetate
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Canonical SMILES
COC(=O)CC1Cc2cc(Cl)ccc2-n2c1nnc2[C@H]1CC[C@@H](CC1)Oc1ccccn1
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Compound Formula C24H25ClN4O3
Compound Structure
Protein Name
Vasopressin V1a receptor
Protein Classification
Membrane receptor
>
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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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
CL000094 1321N1 Homo sapiens (Human)  2
1
IC50 = 220 nM
   TI
   LI
   LO
   TS
2
Ki = 28 nM
   TI
   LI
   LO
   TS