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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	CHEMBL323430
Molecular formula	C27H25N3O6
IUPAC name	(E)-N-[(4aS,7aR)-9-hydroxy-3,7a-dimethyl-7-oxo-1,2,4,13-tetrahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl]-3-(4-nitrophenyl)prop-2-enamide
Molecular weight	487.512
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	2.9
Synonyms	1N-[10-hydroxy-4,13-dimethyl-14-oxo-(13R,17S)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10,15-tetraen-17-yl]-4-(4-nitrophenyl)-(Z)-2-butenamide BDBM50033648
Inchi Key	OQLYXAVKLPHPHZ-HVCZEULHSA-N
Inchi ID	InChI=1S/C27H25N3O6/c1-25-21(32)11-12-27(28-22(33)10-5-16-3-7-18(8-4-16)30(34)35)20-15-17-6-9-19(31)24(36-25)23(17)26(25,27)13-14-29(20)2/h3-12,20,31H,13-15H2,1-2H3,(H,28,33)/b10-5+/t20?,25-,26?,27+/m0/s1
PubChem CID	44337273
ChEMBL	CHEMBL323430
IUPHAR	N/A
BindingDB	50033648
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
247937	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
247938	Kappa-type opioid receptor	P41145	OPRK1	Homo sapiens (Human)	380
247939	Mu-type opioid receptor	P79350	OPRM1	Bos taurus (Bovine)	401

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