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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	CHEMBL57879
Molecular formula	C16H23NO2
IUPAC name	9-(hydroxymethyl)-1-methyl-10-(methylamino)tricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol
Molecular weight	261.365
Hydrogen bond acceptor	3
Hydrogen bond donor	3
XlogP	2.7
Synonyms	BDBM50050480 9-Hydroxymethyl-1-methyl-10-methylamino-tricyclo[7.3.1.02,7]trideca-2,4,6-trien-4-ol
Inchi Key	HBHHFUIZPMLGCC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H23NO2/c1-15-6-5-14(17-2)16(9-15,10-18)8-11-3-4-12(19)7-13(11)15/h3-4,7,14,17-19H,5-6,8-10H2,1-2H3
PubChem CID	44301653
ChEMBL	CHEMBL57879
IUPHAR	N/A
BindingDB	50050480
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
110496	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
110494	Kappa-type opioid receptor	P41144	OPRK1	Cavia porcellus (Guinea pig)	380
110495	Mu-type opioid receptor	P79350	OPRM1	Bos taurus (Bovine)	401

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