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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	CHEMBL3814950
Molecular formula	C26H36N4O2
IUPAC name	(3R)-7-hydroxy-N-[(2S)-3-methyl-1-(4-methyl-4-pyridin-3-ylpiperidin-1-yl)butan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Molecular weight	436.6
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	3.5
Synonyms	(R)-7-Hydroxy-N-[(1S)-2-methyl-1-[[4-methyl-4-(3-pyridinyl)piperidino]methyl]propyl]-1,2,3,4-tetrahydroisoquinoline-3beta-carboxamide J3.554.818A
Inchi Key	ACGTWYAXONAROP-DNQXCXABSA-N
Inchi ID	InChI=1S/C26H36N4O2/c1-18(2)24(17-30-11-8-26(3,9-12-30)21-5-4-10-27-16-21)29-25(32)23-14-19-6-7-22(31)13-20(19)15-28-23/h4-7,10,13,16,18,23-24,28,31H,8-9,11-12,14-15,17H2,1-3H3,(H,29,32)/t23-,24-/m1/s1
PubChem CID	127052128
ChEMBL	CHEMBL3814950
IUPHAR	N/A
BindingDB	N/A
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
521477	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
521479	Kappa-type opioid receptor	P41145	OPRK1	Homo sapiens (Human)	380
521478	Mu-type opioid receptor	P35372	OPRM1	Homo sapiens (Human)	400

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