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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	CHEMBL2163544
Molecular formula	C26H29N3O4
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-aminobenzamide
Molecular weight	447.535
Hydrogen bond acceptor	6
Hydrogen bond donor	4
XlogP	0.5
Synonyms	BDBM50395109
Inchi Key	ANIPKBHQLXNORM-HJUABUFYSA-N
Inchi ID	InChI=1S/C26H29N3O4/c1-2-11-29-12-10-25-21-15-6-7-19(30)22(21)33-23(25)18(8-9-26(25,32)20(29)14-15)28-24(31)16-4-3-5-17(27)13-16/h2-7,13,18,20,23,30,32H,1,8-12,14,27H2,(H,28,31)/t18-,20-,23+,25+,26-/m1/s1
PubChem CID	60195558
ChEMBL	CHEMBL2163544
IUPHAR	N/A
BindingDB	50395109
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
9604	Delta-type opioid receptor	P32300	Oprd1	Mus musculus (Mouse)	372
9603	Kappa-type opioid receptor	P33534	Oprk1	Mus musculus (Mouse)	380
9605	Mu-type opioid receptor	P42866	Oprm1	Mus musculus (Mouse)	398

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