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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.
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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	CHEMBL408028
Molecular formula	C21H29NO3
IUPAC name	4-(1-methoxybutan-2-yloxy)-3,6-dimethyl-2-(2,4,6-trimethylphenoxy)pyridine
Molecular weight	343.467
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	5.4
Synonyms	SCHEMBL5844424 4-[(1-methoxybutan-2-yl)oxy]-3,6-dimethyl-2-(2,4,6-trimethylphenoxy)pyridine 2-Aryloxy-4-alkoxy-pyridine, 43 BDBM20962
Inchi Key	CWNKUKVWCWLOSD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H29NO3/c1-8-18(12-23-7)24-19-11-16(5)22-21(17(19)6)25-20-14(3)9-13(2)10-15(20)4/h9-11,18H,8,12H2,1-7H3
PubChem CID	9819482
ChEMBL	CHEMBL408028
IUPHAR	N/A
BindingDB	20962
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	10.96 nM	PMID18260619	ChEMBL
IC50	11.0 nM	PMID18260619	BindingDB,ChEMBL

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