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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL330138
Molecular formula	C19H25NOS
IUPAC name	3-[(3R,4R)-3,4-dimethyl-1-(2-thiophen-2-ylethyl)piperidin-4-yl]phenol
Molecular weight	315.475
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	4.8
Synonyms	3-[(3R,4R)-3,4-Dimethyl-1-[2-(2-thienyl)ethyl]-4-piperidinyl]phenol BDBM50045762 ZINC13832999 3-[3,4-Dimethyl-1-(2-thiophen-2-yl-ethyl)-piperidin-4-yl]-phenol
Inchi Key	DGEXSDIRTDWGOA-HNAYVOBHSA-N
Inchi ID	InChI=1S/C19H25NOS/c1-15-14-20(10-8-18-7-4-12-22-18)11-9-19(15,2)16-5-3-6-17(21)13-16/h3-7,12-13,15,21H,8-11,14H2,1-2H3/t15-,19+/m0/s1
PubChem CID	10381008
ChEMBL	CHEMBL330138
IUPHAR	N/A
BindingDB	50045762
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
59192	Kappa-type opioid receptor	P34975	Oprk1	Rattus norvegicus (Rat)	380
59194	Kappa-type opioid receptor	P41144	OPRK1	Cavia porcellus (Guinea pig)	380
59195	Kappa-type opioid receptor	P33534	Oprk1	Mus musculus (Mouse)	380
59193	Mu-type opioid receptor	P33535	Oprm1	Rattus norvegicus (Rat)	398
59196	Mu-type opioid receptor	P42866	Oprm1	Mus musculus (Mouse)	398

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