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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	Alpha-1B adrenergic receptor
Species	Mus musculus (Mouse)
Gene	Adra1b
Synonym	alpha1B-adrenoceptor alpha1B-adrenergic receptor Alpha-1B adrenoreceptor Alpha-1B adrenoceptor alpha 1B-adrenoreceptor alpha 1B-adrenoceptor adrenergic receptor adrenergic alpha 1B receptor [ Show all ]
Disease	N/A for non-human GPCRs
Length	514
Amino acid sequence	MNPDLDTGHNTSAPAHWGELKDANFTGPNQTSSNSTLPQLDVTRAISVGCLGAFILFAIVGNILVILSVACNRHLRTPTNYFIVNLAIADLLLSFTDLPFSATLEVLGYWVLGRIFCDIWAAVDVLCCTASILSLCAISIDRYIGVRYSLQYPTLVTRRKAILALLSVWVLSTVISIGPLLGWKEPAPNDDKECGVTEEPFYALFSSLGSFYIPLAVILVMYCRVYIVAKRTTKNLEAGVMKEMSNSKELTLRIHSKNFHEDTLSSTKAKGHNPRSSIAVKLFKFSREKKAAKTLGIVVGMFILCWLPFFIALPLGSLFSTLKPPDAVFKVVFWLGYFNSCLNPIIYPCSSKEFKRAFMRILGCQCRGGRRRRRRRRLGACAYTYRPWTRGGSLERSQSRKDSLDDSGSCMSGSQRTLPSASPSPGYLGRGTQPPVELCAFPEWKPGALLSLPEPPGRRGRLDSGPLFTFKLLGEPESPGTEGDASNGGCDTTTDLANGQPGFKSNMPLAPGHF
UniProt	P97717
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	CHEMBL2486
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL3946661
Molecular formula	C21H26N2O2
IUPAC name	(2S)-4-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(phenoxymethyl)morpholine
Molecular weight	338.451
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.5
Synonyms	ZKTUDHGKQCWRDH-FQEVSTJZSA-N BDBM186927 SCHEMBL14061666 (S)-4-(2-(Indolin-1-yl)ethyl)-2-(phenoxymethyl)morpholine US9079895, 19s
Inchi Key	ZKTUDHGKQCWRDH-FQEVSTJZSA-N
Inchi ID	InChI=1S/C21H26N2O2/c1-2-7-19(8-3-1)25-17-20-16-22(14-15-24-20)12-13-23-11-10-18-6-4-5-9-21(18)23/h1-9,20H,10-17H2/t20-/m0/s1
PubChem CID	71062646
ChEMBL	CHEMBL3946661
IUPHAR	N/A
BindingDB	186927
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	7211.0 nM	, None	BindingDB,ChEMBL

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