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GLASS

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

Name	Corticotropin-releasing factor receptor 1
Species	Rattus norvegicus (Rat)
Gene	Crhr1
Synonym	CRH-R1 CRH-R-1 CRFR1 CRFR-1 CRF1 receptor CRF-RA CRF-R1alpha CRF-R1 CRF-R-1 CRF-R CRF 1 receptor Corticotropin-releasing hormone receptor 1 CRHR [ Show all ]
Disease	N/A for non-human GPCRs
Length	415
Amino acid sequence	MGRRPQLRLVKALLLLGLNPVSTSLQDQRCENLSLTSNVSGLQCNASVDLIGTCWPRSPAGQLVVRPCPAFFYGVRYNTTNNGYRECLANGSWAARVNYSECQEILNEEKKSKVHYHVAVIINYLGHCISLVALLVAFVLFLRLRSIRCLRNIIHWNLISAFILRNATWFVVQLTVSPEVHQSNVAWCRLVTAAYNYFHVTNFFWMFGEGCYLHTAIVLTYSTDRLRKWMFVCIGWGVPFPIIVAWAIGKLHYDNEKCWFGKRPGVYTDYIYQGPMILVLLINFIFLFNIVRILMTKLRASTTSETIQYRKAVKATLVLLPLLGITYMLFFVNPGEDEVSRVVFIYFNSFLESFQGFFVSVFYCFLNSEVRSAIRKRWRRWQDKHSIRARVARAMSIPTSPTRVSFHSIKQSTAV
UniProt	P35353
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	CHEMBL4649
IUPHAR	212
DrugBank	N/A

Ligand

Name	CHEMBL166102
Molecular formula	C15H18BrN3
IUPAC name	N-(2-bromo-4-ethylphenyl)-N,4,6-trimethylpyrimidin-2-amine
Molecular weight	320.234
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	4.5
Synonyms	SCHEMBL7680278 ZINC13794379 BDBM50074398 N,4,6-Trimethyl-N-(2-bromo-4-ethylphenyl)pyrimidine-2-amine (2-Bromo-4-ethyl-phenyl)-(4,6-dimethyl-pyrimidin-2-yl)-methyl-amine
Inchi Key	BJBJQLPFJLBRHO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H18BrN3/c1-5-12-6-7-14(13(16)9-12)19(4)15-17-10(2)8-11(3)18-15/h6-9H,5H2,1-4H3
PubChem CID	10663467
ChEMBL	CHEMBL166102
IUPHAR	N/A
BindingDB	50074398
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	187.0 nM	PMID10072679	BindingDB,ChEMBL

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