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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	Mu-type opioid receptor
Species	Rattus norvegicus (Rat)
Gene	Oprm1
Synonym	Opioid receptor B opioid receptor OP3 mu receptor MOR-1 MOPr MOP M-OR-1 opioid receptor, mu 1 [ Show all ]
Disease	N/A for non-human GPCRs
Length	398
Amino acid sequence	MDSSTGPGNTSDCSDPLAQASCSPAPGSWLNLSHVDGNQSDPCGLNRTGLGGNDSLCPQTGSPSMVTAITIMALYSIVCVVGLFGNFLVMYVIVRYTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGTILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDFRTPRNAKIVNVCNWILSSAIGLPVMFMATTKYRQGSIDCTLTFSHPTWYWENLLKICVFIFAFIMPVLIITVCYGLMILRLKSVRMLSGSKEKDRNLRRITRMVLVVVAVFIVCWTPIHIYVIIKALITIPETTFQTVSWHFCIALGYTNSCLNPVLYAFLDENFKRCFREFCIPTSSTIEQQNSTRVRQNTREHPSTANTVDRTNHQLENLEAETAPLP
UniProt	P33535
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	CHEMBL270
IUPHAR	319
DrugBank	N/A

Ligand

Name	CHEMBL346163
Molecular formula	C16H23NO
IUPAC name	3-[1-(cyclopropylmethyl)-3-methylpiperidin-3-yl]phenol
Molecular weight	245.366
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	3.4
Synonyms	3-(1-Cyclopropylmethyl-3-methyl-piperidin-3-yl)-phenol BDBM50021324 3-(1-Cyclopropylmethyl-3-methyl-piperidin-3-yl)-phenol:hydrochloricacid
Inchi Key	BFJGDYASFRFDRK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H23NO/c1-16(14-4-2-5-15(18)10-14)8-3-9-17(12-16)11-13-6-7-13/h2,4-5,10,13,18H,3,6-9,11-12H2,1H3
PubChem CID	13615888
ChEMBL	CHEMBL346163
IUPHAR	N/A
BindingDB	50021324
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Kd	32.0 nM	PMID3007760	BindingDB,ChEMBL
Kd	43.0 nM	PMID3007760	ChEMBL
Kd	120.0 nM	PMID3007760	ChEMBL
Kd	256.0 nM	PMID3007760	BindingDB,ChEMBL

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