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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	CHEMBL48526
Molecular formula	C23H27ClN4O4
IUPAC name	methyl 1-[2-[4-[[2-butyl-4-chloro-5-(hydroxymethyl)imidazol-1-yl]methyl]anilino]-2-oxoethyl]pyrrole-2-carboxylate
Molecular weight	458.943
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	3.4
Synonyms	1-[2-[[4-[(2-Butyl-4-chloro-5-hydroxymethyl-1H-imidazol-1-yl)methyl]phenyl]amino]-2-oxoethyl]-1H-pyrrole-2-carboxylic acid methyl ester BDBM50047936 1-{[4-(2-Butyl-4-chloro-5-hydroxymethyl-imidazol-1-ylmethyl)-phenylcarbamoyl]-methyl}-1H-pyrrole-2-carboxylic acid methyl ester
Inchi Key	GONUYIXKBIPRQU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H27ClN4O4/c1-3-4-7-20-26-22(24)19(15-29)28(20)13-16-8-10-17(11-9-16)25-21(30)14-27-12-5-6-18(27)23(31)32-2/h5-6,8-12,29H,3-4,7,13-15H2,1-2H3,(H,25,30)
PubChem CID	44293406
ChEMBL	CHEMBL48526
IUPHAR	N/A
BindingDB	50047936
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	8370.0 nM	PMID8510101	BindingDB
IC50	8370.0 nM	PMID8510101	ChEMBL

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