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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	CHEMBL2163546
Molecular formula	C26H28N2O5
IUPAC name	N-[(4R,4aS,7R,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]-3-hydroxybenzamide
Molecular weight	448.519
Hydrogen bond acceptor	6
Hydrogen bond donor	4
XlogP	0.8
Synonyms	BDBM50395107
Inchi Key	CXONYIWQLLTLGQ-HJUABUFYSA-N
Inchi ID	InChI=1S/C26H28N2O5/c1-2-11-28-12-10-25-21-15-6-7-19(30)22(21)33-23(25)18(8-9-26(25,32)20(28)14-15)27-24(31)16-4-3-5-17(29)13-16/h2-7,13,18,20,23,29-30,32H,1,8-12,14H2,(H,27,31)/t18-,20-,23+,25+,26-/m1/s1
PubChem CID	60195635
ChEMBL	CHEMBL2163546
IUPHAR	N/A
BindingDB	50395107
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
52987	Delta-type opioid receptor	P32300	Oprd1	Mus musculus (Mouse)	372
52986	Kappa-type opioid receptor	P33534	Oprk1	Mus musculus (Mouse)	380
52988	Mu-type opioid receptor	P42866	Oprm1	Mus musculus (Mouse)	398

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