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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	B1 bradykinin receptor
Species	Mus musculus (Mouse)
Gene	Bdkrb1
Synonym	bradykinin receptor BKR1 BK-1 receptor B1R B1BKR B1 receptor kinin B1 receptor [ Show all ]
Disease	N/A for non-human GPCRs
Length	334
Amino acid sequence	MASQASLKLQPSNQSQQAPPNITSCEGAPEAWDLLCRVLPGFVITVCFFGLLGNLLVLSFFLLPWRRWWQQRRQRLTIAEIYLANLAASDLVFVLGLPFWAENVGNRFNWPFGSDLCRVVSGVIKANLFISIFLVVAISQDRYRLLVYPMTSWGNRRRRQAQVTCLLIWVAGGLLSTPTFLLRSVKVVPDLNISACILLFPHEAWHFVRMVELNVLGFLLPLAAILYFNFHILASLRGQKEASRTRCGGPKDSKTMGLILTLVASFLVCWAPYHFFAFLDFLVQVRVIQDCFWKELTDLGLQLANFFAFVNSCLNPLIYVFAGRLFKTRVLGTL
UniProt	Q61125
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	CHEMBL1250407
IUPHAR	41
DrugBank	N/A

Ligand

Name	CHEMBL2087034
Molecular formula	C22H26Cl2N4O3S
IUPAC name	3-[(2,4-dichloro-3-methylphenyl)sulfonyl-methylamino]-N-[[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]methyl]-N-methylpropanamide
Molecular weight	497.435
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	2.6
Synonyms	SCHEMBL4031067 BDBM50420593
Inchi Key	LVSVBFYPWNCMMM-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H26Cl2N4O3S/c1-15-18(23)8-9-19(21(15)24)32(30,31)28(3)13-10-20(29)27(2)14-16-4-6-17(7-5-16)22-25-11-12-26-22/h4-9H,10-14H2,1-3H3,(H,25,26)
PubChem CID	12085130
ChEMBL	CHEMBL2087034
IUPHAR	N/A
BindingDB	50420593
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
pKb	6.4 -	PMID22369198	ChEMBL

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