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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	Parathyroid hormone/parathyroid hormone-related peptide receptor
Species	Homo sapiens (Human)
Gene	PTH1R
Synonym	PTH1 receptor PTHR PTH/PTHrP type I receptor PTH/PTHr receptor PPR Parathyroid hormone 1 receptor PTHR1 [ Show all ]
Disease	N/A
Length	593
Amino acid sequence	MGTARIAPGLALLLCCPVLSSAYALVDADDVMTKEEQIFLLHRAQAQCEKRLKEVLQRPASIMESDKGWTSASTSGKPRKDKASGKLYPESEEDKEAPTGSRYRGRPCLPEWDHILCWPLGAPGEVVAVPCPDYIYDFNHKGHAYRRCDRNGSWELVPGHNRTWANYSECVKFLTNETREREVFDRLGMIYTVGYSVSLASLTVAVLILAYFRRLHCTRNYIHMHLFLSFMLRAVSIFVKDAVLYSGATLDEAERLTEEELRAIAQAPPPPATAAAGYAGCRVAVTFFLYFLATNYYWILVEGLYLHSLIFMAFFSEKKYLWGFTVFGWGLPAVFVAVWVSVRATLANTGCWDLSSGNKKWIIQVPILASIVLNFILFINIVRVLATKLRETNAGRCDTRQQYRKLLKSTLVLMPLFGVHYIVFMATPYTEVSGTLWQVQMHYEMLFNSFQGFFVAIIYCFCNGEVQAEIKKSWSRWTLALDFKRKARSGSSSYSYGPMVSHTSVTNVGPRVGLGLPLSPRLLPTATTNGHPQLPGHAKPGTPALETLETTPPAMAAPKDDGFLNGSCSGLDEEASGPERPPALLQEEWETVM
UniProt	Q03431
Protein Data Bank	6fj3, 3h3g, 3c4m
GPCR-HGmod model	N/A
3D structure model	This structure is from PDB ID 6fj3.
BioLiP	BL0161387, BL0433539,BL0433540, BL0161388, BL0143680,BL0143682, BL0143681,BL0143683
Therapeutic Target Database	N/A
ChEMBL	CHEMBL1793
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
Potency	125892.0 nM	PubChem BioAssay data set	ChEMBL

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