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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-1A adrenergic receptor
Species	Bos taurus (Bovine)
Gene	ADRA1A
Synonym	Alpha-1A adrenoceptor Alpha-1A adrenoreceptor Alpha-1C adrenergic receptor
Disease	N/A for non-human GPCRs
Length	466
Amino acid sequence	MVFLSGNASDSSNCTHPPPPVNISKAILLGVILGGLILFGVLGNILVILSVACHRHLHSVTHYYIVNLAVADLLLTSTVLPFSAIFEILGYWAFGRVFCNVWAAVDVLCCTASIMGLCIISIDRYIGVSYPLRYPTIVTQKRGLMALLCVWALSLVISIGPLFGWRQPAPEDETICQINEEPGYVLFSALGSFYVPLTIILVMYCRVYVVAKRESRGLKSGLKTDKSDSEQVTLRIHRKNAQVGGSGVTSAKNKTHFSVRLLKFSREKKAAKTLGIVVGCFVLCWLPFFLVMPIGSFFPDFRPSETVFKIAFWLGYLNSCINPIIYPCSSQEFKKAFQNVLRIQCLRRKQSSKHTLGYTLHAPSHVLEGQHKDLVRIPVGSAETFYKISKTDGVCEWKIFSSLPRGSARMAVARDPSACTTARVRSKSFLQVCCCLGPSTPSHGENHQIPTIKIHTISLSENGEEV
UniProt	P18130
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	CHEMBL4892
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	1-(6-chloropyridin-2-yl)piperazine
Molecular formula	C9H12ClN3
IUPAC name	1-(6-chloropyridin-2-yl)piperazine
Molecular weight	197.666
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	1.6
Synonyms	I13-476 NCGC00246552-01 ZINC3016267 AB03807 KQFRTJUIRPBBAB-UHFFFAOYSA-N SBB092221 1-(6-chloranylpyridin-2-yl)piperazine AKOS005070696 CTK3C4276 FT-0680492 MLS000694825 SMR000333134 1-(6-Chloro-pyridin-2-yl)-piperazine 87394-54-5 C-4390 J-503465 Piperazine, 1-(6-chloro-2-pyridinyl)- 2-Chloro-6-piperazinopyridine AC1MIGIH CHEMBL45773 DB-076938 KS-00001Y68 SC-35607 1-(6-chloro-2-pyridinyl)piperazine 6-chloro-2-(1-piperazinyl)pyridine BB 0248181 HMS2650N19 MolPort-000-002-932 TR-027343 1-(6-chloro-pyridin-2-yl)-piperazine, AldrichCPR A842123 C67429 KB-09399 RP11627 (6-chloro-2-pyridyl)piperazine 3830AC AJ-77348 chloropyridinylpiperazine DTXSID80388575 MCULE-9502003421 SCHEMBL615260 1-(6-chloro-2-pyridyl)piperazine 6B-103 BDBM50027021 [ Show all ]
Inchi Key	KQFRTJUIRPBBAB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C9H12ClN3/c10-8-2-1-3-9(12-8)13-6-4-11-5-7-13/h1-3,11H,4-7H2
PubChem CID	3024499
ChEMBL	CHEMBL45773
IUPHAR	N/A
BindingDB	50027021
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	375.0 nM	PMID6139479	BindingDB,ChEMBL

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