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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	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	CHEMBL273033
Molecular formula	C23H33NO3
IUPAC name	2-(2,6-dimethyl-4-propan-2-yloxyphenoxy)-3,6-dimethyl-4-pentan-3-yloxypyridine
Molecular weight	371.521
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	6.8
Synonyms	2-[2,6-dimethyl-4-(propan-2-yloxy)phenoxy]-3,6-dimethyl-4-(pentan-3-yloxy)pyridine SCHEMBL5845074 4-(1-Ethyl-propoxy)-2-(4-isopropoxy-2.6-dimethyl-phenoxy)-3,6-dimethyl-pyridine BDBM20956 2-Aryloxy-4-alkoxy-pyridine, 37 DJOXVWGBBGPQEH-UHFFFAOYSA-N 4-(1-ethyl-propoxy)-2-(4-isopropoxy-2,6-dimethyl-phenoxy)-3,6-dimethyl-pyridine [ Show all ]
Inchi Key	DJOXVWGBBGPQEH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H33NO3/c1-9-19(10-2)26-21-13-17(7)24-23(18(21)8)27-22-15(5)11-20(12-16(22)6)25-14(3)4/h11-14,19H,9-10H2,1-8H3
PubChem CID	21912397
ChEMBL	CHEMBL273033
IUPHAR	N/A
BindingDB	20956
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	109.65 nM	PMID18260619	ChEMBL
IC50	110.0 nM	PMID18260619	BindingDB,ChEMBL

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