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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Type-1B angiotensin II receptor
Species	Rattus norvegicus (Rat)
Gene	Agtr1b
Synonym	Angiotensin II type-1B receptor AT1B AT3
Disease	N/A for non-human GPCRs
Length	359
Amino acid sequence	MTLNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNHLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLMAGLASLPAVIYRNVYFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFVFPFLIILTSYTLIWKALKKAYKIQKNTPRNDDIFRIIMAIVLFFFFSWVPHQIFTFLDVLIQLGIIRDCEIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPTAKSHAGLSTKMSTLSYRPSDNMSSSAKKSASFFEVE
UniProt	P29089
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL263
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL78532
Molecular formula	C24H24N8S
IUPAC name	7-butyl-5-methyl-8-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-2H-[1,2,4]triazolo[4,3-c]pyrimidine-3-thione
Molecular weight	456.572
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	4.2
Synonyms	7-Butyl-5-methyl-8-[[2'-(1H-tetrazol-5-yl)-1,1'-biphenyl-4-yl]methyl]-1,2,4-triazolo[4,3-c]pyrimidine-3-thiol BDBM50039373 SCHEMBL9309975 7-Butyl-5-methyl-8-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-[1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
Inchi Key	AEPGYTQBSCNETR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H24N8S/c1-3-4-9-21-20(23-28-29-24(33)32(23)15(2)25-21)14-16-10-12-17(13-11-16)18-7-5-6-8-19(18)22-26-30-31-27-22/h5-8,10-13H,3-4,9,14H2,1-2H3,(H,29,33)(H,26,27,30,31)
PubChem CID	10027078
ChEMBL	CHEMBL78532
IUPHAR	N/A
BindingDB	50039373
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	106.0 nM	PMID8057285	BindingDB,ChEMBL

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